SCHEMBL5545779

SCHEMBL5545779

Nc1cccc(COC=O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.47
MAOA P21397 2/20 0.47
CYP19A1 P11511 2/20 0.46
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
CYP3A4 P08684 1/20 0.41
CASP1 P29466 1/20 0.41
RECQL P46063 1/20 0.41
AS3MT Q9HBK9 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
ACHE P22303 1/20 0.40
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
CA12 O43570 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CA7 P43166 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CA14 Q9ULX7 1/20 0.39
APP P05067 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11394076 0.86 MAOB (0.39) MAOBMAOACYP3A4
SCHEMBL27693392 0.82 MAOB (0.47) MAOBMAOA
SCHEMBL5546017 0.81 MAOB (0.53) MAOBMAOACYP19A1THRATHRB
SCHEMBL5165545 0.81 MAOB (0.47) MAOBMAOACYP19A1THRATHRB
SCHEMBL12548720 0.79 MGLL (0.32)
Ethoxycarbonyl Group SCHEMBL28280206 0.79 CYP3A4 (0.43) MAOBMAOACYP19A1CYP3A4CASP1
SCHEMBL7359415 0.78 ENPP2 (0.50) CYP3A4CA2CA9CA12ALDH1A1
SCHEMBL366865 0.77 MAOB (0.56) MAOBMAOACYP19A1THRATHRB
SCHEMBL95134 0.77 IDO1 (0.58) MAOBMAOA
SCHEMBL15723548 0.77 MRGPRX4 (0.45) MAOBMAOAMRGPRX4CYP11B1CYP11B2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 136 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118339165-A Antibody-drug conjugates and methods of use thereof R.P.谢勒技术有限责任公司 2024-07-12 CN claimed
US-20240197907-A1 Dual-Cleavage Ester Linkers for Antibody-Drug Conjugates ARES CAPITAL CORPORATION, AS COLLATERAL AGENT 2024-06-20 US claimed
US-20240166693-A1 METHODS AND COMPOUNDS FOR MODULATING MYOTONIC DYSTROPY 1 Design Therapeutics, Inc. 2024-05-23 US claimed
US-20240148883-A1 Branched Linkers for Antibody-Drug Conjugates and Methods of Use Thereof ARES CAPITAL CORPORATION, AS COLLATERAL AGENT 2024-05-09 US claimed
US-20240124491-A1 METHODS AND COMPOUNDS FOR TREATING FRIEDREICH'S ATAXIA Design Therapeutics, Inc. 2024-04-18 US claimed
WO-2024054821-A2 TISSUE FACTOR ANTIBODY-DRUG CONJUGATES AND USES THEREOF EXELIXIS, INC. (US) 2024-03-14 WO claimed
CN-117279662-A Branched linkers for antibody-drug conjugates and methods of use thereof R.P.谢勒技术有限责任公司 2023-12-22 CN claimed
EP-4274583-A2 METHODS AND COMPOUNDS FOR TREATING FRIEDREICH'S ATAXIA Design Therapeutics, Inc. (US) 2023-11-15 EP claimed
EP-4259133-A1 METHODS AND COMPOUNDS FOR MODULATING MYOTONIC DYSTROPHY 1 Design Therapeutics, Inc. (US) 2023-10-18 EP claimed
CN-116847844-A Camptothecine antibody-drug conjugates and methods of use thereof R.P.谢勒技术有限责任公司 2023-10-03 CN claimed
US-20190192680-A1 Hydrazinyl-Substituted Heteroaryl Compounds and Methods for Producing a Conjugate REDWOOD BIOSCIENCE, INC. 2019-06-27 US claimed
WO-2019113248-A1 ANTI-UPAR ANTIBODY-DRUG CONJUGATES AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-06-13 WO claimed
US-10195283-B2 Hydrazinyl-substituted heteroaryl compounds and methods for producing a conjugate R.P. SCHERER TECHNOLOGIES, LLC (US) 2019-02-05 US claimed
US-20180215783-A1 BIOORTHOGONAL REACTION OF AN AMINE N-OXIDE AND A BORON AGENT THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-08-02 US claimed
US-20170266302-A1 Hydrazinyl-Substituted Heteroaryl Compounds and Methods for Producing a Conjugate R.P. SCHERER TECHNOLOGIES, LLC 2017-09-21 US claimed
US-20170049907-A1 HYDRAZINYL-PYRROLO COMPOUNDS AND METHODS FOR PRODUCING A CONJUGATE CATALENT PHARMA SOLUTIONS, LLC 2017-02-23 US claimed
US-9493413-B2 Hydrazinyl-pyrrolo compounds and methods for producing a conjugate REDWOOD BIOSCIENCE, INC. (US) 2016-11-15 US claimed
EP-3074010-A1 HYDRAZINYL-PYRROLO COMPOUNDS AND METHODS FOR PRODUCING A CONJUGATE Redwood Bioscience, Inc. (US) 2016-10-05 EP claimed
US-20150157736-A1 HYDRAZINYL-PYRROLO COMPOUNDS AND METHODS FOR PRODUCING A CONJUGATE R.P. SCHERER TECHNOLOGIES, LLC 2015-06-11 US claimed
WO-2015081282-A1 HYDRAZINYL-PYRROLO COMPOUNDS AND METHODS FOR PRODUCING A CONJUGATE REDWOOD BIOSCIENCE, INC. (US) 2015-06-04 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240124491-A1 METHODS AND COMPOUNDS FOR TREATING FRIEDREICH'S ATAXIA ATXN2, ATXN2L, CDR2 MAOB 1034/4885MAOA 1289/4885CYP19A1 4797/4885
US-20150157736-A1 HYDRAZINYL-PYRROLO COMPOUNDS AND METHODS FOR PRODUCING A CONJUGATE DNPEP, QPCT, PDS5A MAOB 1555/4885MAOA 1392/4885CYP19A1 2570/4885
US-20240197907-A1 Dual-Cleavage Ester Linkers for Antibody-Drug Conjugates ADAM8, BCR, JMJD7 MAOB 1662/4885MAOA 1553/4885CYP19A1 1141/4885
US-20170049907-A1 HYDRAZINYL-PYRROLO COMPOUNDS AND METHODS FOR PRODUCING A CONJUGATE DNPEP, QPCT, PDS5A MAOB 1555/4885MAOA 1392/4885CYP19A1 2570/4885
US-20240166693-A1 METHODS AND COMPOUNDS FOR MODULATING MYOTONIC DYSTROPY 1 MTPN, DMPK, MBNL1 MAOB 2507/4885MAOA 3033/4885CYP19A1 4649/4885
US-20180215783-A1 BIOORTHOGONAL REACTION OF AN AMINE N-OXIDE AND A BORON AGENT BBOX1, BLVRB, BTD MAOB 11/4885MAOA 48/4885CYP19A1 627/4885
US-10195283-B2 Hydrazinyl-substituted heteroaryl compounds and methods for producing a conjugate HNMT, TIAL1, HACL2 MAOB 625/4885MAOA 448/4885CYP19A1 1001/4885
US-20190192680-A1 Hydrazinyl-Substituted Heteroaryl Compounds and Methods for Producing a Conjugate HNMT, TIAL1, HACL2 MAOB 625/4885MAOA 448/4885CYP19A1 1001/4885
US-20170266302-A1 Hydrazinyl-Substituted Heteroaryl Compounds and Methods for Producing a Conjugate HNMT, TIAL1, HACL2 MAOB 625/4885MAOA 448/4885CYP19A1 1001/4885
US-20240148883-A1 Branched Linkers for Antibody-Drug Conjugates and Methods of Use Thereof CD22, CLTB, BCR MAOB 1061/4885MAOA 1574/4885CYP19A1 4371/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.