SCHEMBL4761633

SCHEMBL4761633

CCNC(=O)C1CCC(CN2C(=O)C=CC2=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.38
ALDH1A1 P00352 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
BLM P54132 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
WRN Q14191 1/20 0.38
HIF1A Q16665 1/20 0.38
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 2/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
OPRM1 P35372 1/20 0.37
TSHR P16473 2/20 0.36
CCR8 P51685 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
LMNA P02545 4/20 0.36
MEN1 O00255 1/20 0.36
MAPK10 P53779 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL10147986 0.89 HPGD (0.45) HPGDALDH1A1SMN1; SMN2KDM4EHSD17B10
SCHEMBL19116912 0.89 HPGD (0.45) HPGDALDH1A1SMN1; SMN2KDM4EHSD17B10
SCHEMBL4761616 0.86 SMN1; SMN2 (0.49) ALDH1A1CYP2C19SMN1; SMN2KDM4ECYP2D6
SCHEMBL890523 0.86 CTH (0.39) HPGDALDH1A1CYP1A2CYP2C19BLM
SCHEMBL18165220 0.86 CTH (0.39) HPGDALDH1A1CYP1A2CYP2C19BLM
SCHEMBL11990499 0.85 SMN1; SMN2 (0.53) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL12092098 0.85 LMNA (0.47) HPGDALDH1A1CYP1A2CYP2C19BLM
SCHEMBL20434520 0.85 EPHX2 (0.44) HPGDALDH1A1SMN1; SMN2LMNAMEN1
SCHEMBL18461344 0.85 SMN1; SMN2 (0.42) HPGDALDH1A1CYP1A2CYP2C19BLM
SCHEMBL14872066 0.84 NAAA (0.55) ALDH1A1SMN1; SMN2LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219962-A1 PYRAZOLO[4,3-d]PYRIMIDINE DERIVATIVES AND METHODS OF USE THEREOF FOR THE TREATMENT OF CELLULAR PROLIFERATIVE DISORDERS MERCK SHARP & DOHME LLC (US) 2023-07-13 US disclosed
WO-2021143741-A1 TARGETING POLYPEPTIDE-DRUG CONJUGATE AND USE THEREOF 北京海步医药科技有限公司 2021-07-22 WO disclosed
US-9850318-B2 Antibodies to quetiapine haptens and use thereof JANSSEN PHARMACEUTICA NV (BE) 2017-12-26 US disclosed
US-20170043020-A1 ANTIBODY-MEDIATED DISRUPTION OF QUORUM SENSING IN BACTERIA NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-02-16 US disclosed
US-9394371-B2 Antibody-mediated disruption of quorum sensing in bacteria THE SCRIPPS RESEARCH INSTITUTE (US) 2016-07-19 US disclosed
US-9394371-B2 Antibody-mediated disruption of quorum sensing in bacteria THE SCRIPPS RESEARCH INSTITUTE (US) 2016-07-19 US disclosed
US-9102735-B2 Immunoconjugates with an intracellularly-cleavable linkage IMMUNOMEDICS, INC. (US) 2015-08-11 US disclosed
US-8835556-B2 Hydrolytically stable maleimide-terminated polymers NEKTAR THERAPEUTICS (US) 2014-09-16 US disclosed
US-20120226022-A1 HYDROLYTICALLY STABLE MALEIMIDE-TERMINATED POLYMERS NEKTAR THERAPEUTICS (US) 2012-09-06 US disclosed
US-8227555-B2 Hydrolytically stable maleimide-terminated polymers NEKTAR THERAPEUTICS (US) 2012-07-24 US disclosed
US-20100291093-A1 ANTIBODY-MEDIATED DISRUPTION OF QUORUM SENSING IN BACTERIA THE SCRIPPS RESEARCH INSTITUTE (US) 2010-11-18 US disclosed
US-20090012241-A1 Hydrolytically stable maleimide-terminated polymers NEKTAR THERAPEUTICS AL, CORPORATION (US) 2009-01-08 US disclosed
US-20090012241-A1 Hydrolytically stable maleimide-terminated polymers NEKTAR THERAPEUTICS AL, CORPORATION (US) 2009-01-08 US disclosed
US-7432330-B2 Hydrolytically stable maleimide-terminated polymers NEKTAR THERAPEUTICS AL, CORPORATION (US) 2008-10-07 US disclosed
US-7432330-B2 Hydrolytically stable maleimide-terminated polymers NEKTAR THERAPEUTICS AL, CORPORATION (US) 2008-10-07 US disclosed
US-7432331-B2 Hydrolytically stable maleimide-terminated polymers NEKTAR THERAPEUTICS AL, CORPORATION (US) 2008-10-07 US disclosed
US-7432331-B2 Hydrolytically stable maleimide-terminated polymers NEKTAR THERAPEUTICS AL, CORPORATION (US) 2008-10-07 US disclosed
US-20080171067-A1 Polymeric Carriers of Therapeutic Agents and Recognition Moieties for Antibody-Based Targeting of Disease Sites IMMUNOMEDICS, INC. (US) 2008-07-17 US disclosed
US-20080171067-A1 Polymeric Carriers of Therapeutic Agents and Recognition Moieties for Antibody-Based Targeting of Disease Sites IMMUNOMEDICS, INC. (US) 2008-07-17 US disclosed
WO-2008028206-A2 METHOD FOR PRODUCING REACTIVE MONOLAYER UNITS Universität Linz (AT) 2008-03-13 WO 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 (5 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-20170043020-A1 ANTIBODY-MEDIATED DISRUPTION OF QUORUM SENSING IN BACTERIA CD47, TLR5, ANTXR2 HPGD 4204/4885ALDH1A1 4584/4885CYP1A2 4867/4885
US-20230219962-A1 PYRAZOLO[4,3-d]PYRIMIDINE DERIVATIVES AND METHODS OF USE THEREOF FOR THE TREATMENT OF CELLULAR PROLIFERATIVE DISORDERS DPYD, TYMP, TK1 HPGD 348/4885ALDH1A1 436/4885CYP1A2 2125/4885
US-20120226022-A1 HYDROLYTICALLY STABLE MALEIMIDE-TERMINATED POLYMERS PADI6, MPI, VIM HPGD 1203/4885ALDH1A1 1089/4885CYP1A2 2806/4885
US-20080171067-A1 Polymeric Carriers of Therapeutic Agents and Recognition Moieties for Antibody-Based Targeting of Disease Sites CD47, BSG, SELPLG HPGD 1352/4885ALDH1A1 3965/4885CYP1A2 4853/4885
US-20100291093-A1 ANTIBODY-MEDIATED DISRUPTION OF QUORUM SENSING IN BACTERIA CD47, BCR, TLR5 HPGD 4461/4885ALDH1A1 4701/4885CYP1A2 4870/4885

“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.