SCHEMBL121000

SCHEMBL121000

CC(C=O)COCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
CA1 P00915 4/20 0.47
CA2 P00918 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47
TACR1 P25103 3/20 0.46
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
HTT P42858 1/20 0.44
SLC1A1 P43005 1/20 0.44
CTSB P07858 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL7627184 1.00 TSHR (0.50) TSHRCA1CA2CA7CA9
SCHEMBL5228321 1.00 TSHR (0.50) TSHRCA1CA2CA7CA9
SCHEMBL27694646 0.84 TSHR (0.48) TSHRCA1CA2CA7CA9
SCHEMBL22332007 0.82 KMT2A (0.48) TSHRCA1CA2CA7CA9
SCHEMBL27604046 0.82 TSHR (0.47) TSHRKMT2AMEN1TAAR1HTT
SCHEMBL8030875 0.81 CA1 (0.51) TSHRCA1CA2CA7CA9
SCHEMBL13418948 0.81 TSHR (0.54) TSHRCA1CA2CA7CA9
SCHEMBL7190391 0.81 CA1 (0.54) TSHRCA1CA2HTT
SCHEMBL3557233 0.81 CA1 (0.54) TSHRCA1CA2HTT
SCHEMBL5229745 0.81 CA1 (0.54) TSHRCA1CA2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230287138-A1 PROTEIN-DRUG CONJUGATES COMPRISING CAMPTOTHECIN ANALOGS AND METHODS OF USE THEREOF REGNERON PHARMACEUTICALS, INC. (US) 2023-09-14 US disclosed
US-20190336610-A1 GLUCOSE-SENSITIVE PEPTIDE HORMONES GUBRA APS (DK) 2019-11-07 US disclosed
EP-3558383-A1 GLUCOSE-SENSITIVE PEPTIDE HORMONES Gubra ApS (DK) 2019-10-30 EP disclosed
CN-110087690-A Glucose-sensitive peptide hormone 古布拉有限公司 2019-08-02 CN disclosed
CN-106478651-B Substituted heteroaryl compound and combinations thereof and purposes 广东东阳光药业有限公司 2019-07-09 CN disclosed
EP-3349579-A1 SUBSTITUTED HETEROARYL COMPOUNDS AND METHODS OF USE Sunshine Lake Pharma Co., Ltd. (CN) 2018-07-25 EP disclosed
WO-2018115462-A1 GLUCOSE-SENSITIVE PEPTIDE HORMONES GUBRA APS (DK) 2018-06-28 WO disclosed
US-9758502-B2 Dihydropyrone compounds and herbicides comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-09-12 US disclosed
US-9758502-B2 Dihydropyrone compounds and herbicides comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-09-12 US disclosed
WO-2017048675-A1 SUBSTITUTED HETEROARYL COMPOUNDS AND METHODS OF USE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-03-23 WO disclosed
WO-1999051234-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO., INC. (US) 1999-10-14 WO disclosed
WO-1999051595-A1 ANTAGONISTS OF GONADOTROPIN RELEASING HORMONE MERCK & CO., INC. (US) 1999-10-14 WO disclosed
WO-1998048791-A1 SYNTHESIS OF DISCODERMOLIDE AND ANALOGS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1998-11-05 WO disclosed
WO-1998007734-A9 OLIGONUCLEOTIDE PRODRUGS 1998-04-30 WO disclosed
WO-1998007734-A1 OLIGONUCLEOTIDE PRODRUGS HYBRIDON, INC. (US) 1998-02-26 WO disclosed
EP-0779893-A2 OLIGONUCLEOTIDE PRODRUGS HYBRIDON, Inc. (US) 1997-06-25 EP disclosed
WO-1996007392-A2 OLIGONUCLEOTIDE PRODRUGS HYBRIDON, INC. (US) 1996-03-14 WO disclosed
EP-0223588-B1 PROCESS FOR THE PREPARATION OF BETA-LACTAM COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-06-12 EP disclosed
WO-1988001619-A1 1'-METHYL-BETA-LACTAM COMPOUNDS AND THEIR PRODUCTION SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1988-03-10 WO disclosed
EP-0223588-A1 Process for the preparation of beta-lactam compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-05-27 EP disclosed

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

For each of this compound's patents that has machine-readable text (2 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-20230287138-A1 PROTEIN-DRUG CONJUGATES COMPRISING CAMPTOTHECIN ANALOGS AND METHODS OF USE THEREOF TGM2, QPCT, TGM3 TSHR 3041/4885CA1 949/4885CA2 1524/4885
US-20190336610-A1 GLUCOSE-SENSITIVE PEPTIDE HORMONES IAPP, GCG, VIP TSHR 229/4885CA1 381/4885CA2 1582/4885

“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.