SCHEMBL2631340

SCHEMBL2631340

COC(=O)/C=C/c1cccc(O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.66
CA1 P00915 1/20 0.66
CA2 P00918 1/20 0.66
TYR P14679 1/20 0.66
CA7 P43166 1/20 0.66
CA9 Q16790 1/20 0.66
CA14 Q9ULX7 1/20 0.66
TTR P02766 1/20 0.65
APP P05067 1/20 0.65
PTPN1 P18031 1/20 0.61
P4HB P07237 1/20 0.60
MMP1 P03956 9/20 0.59
MMP2 P08253 9/20 0.59
MMP9 P14780 9/20 0.59
EPHX2 P34913 1/20 0.59
ALDH1A1 P00352 2/20 0.58
MAPT P10636 2/20 0.58
KDM4E B2RXH2 1/20 0.58
MEN1 O00255 1/20 0.58
TP53 P04637 1/20 0.58

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
SCHEMBL30676338 1.00 CA12 (0.66) CA12CA1CA2TYRCA7
SCHEMBL3065424 1.00 CA12 (0.66) CA12CA1CA2TYRCA7
SCHEMBL69618 0.91 TTR (0.66) CA12CA1CA2TYRCA7
SCHEMBL14800037 0.85 AKR1B10 (0.59) P4HBMMP1MMP2MMP9AKR1B10
SCHEMBL2614742 0.84 TTR (0.58) CA12CA1CA2TYRCA7
SCHEMBL2280674 0.84 TTR (0.58) CA12CA1CA2TYRCA7
SCHEMBL13256239 0.84 TTR (0.58) CA12CA1CA2TYRCA7
SCHEMBL4084338 0.84 TTR (0.58) CA12CA1CA2TYRCA7
SCHEMBL2280675 0.84 TTR (0.58) CA12CA1CA2TYRCA7
SCHEMBL31380287 0.84 TTR (0.58) CA12CA1CA2TYRCA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111073469-A Anti-yellowing powder coating for architectural decoration 王磊 2020-04-28 CN claimed
WO-2024242120-A1 PATTERN FORMING METHOD AND PROCESSING LIQUID FOR METAL COMPOUND-CONTAINING FILM 東京応化工業株式会社 2024-11-28 WO disclosed
EP-4438596-A1 DIAMINOPYRIMIDINE DERIVATIVES AS HDAC AND DHFR DUAL-TARGETING INHIBITORS AND USE THEREOF IN PREVENTING AND TREATING MALARIA Université de Lille (FR) 2024-10-02 EP disclosed
US-11725007-B2 Meta tyrosine derivatives as rho-kinase inhibitors CHIESI FARMACEUTICI S.P.A. (IT) 2023-08-15 US disclosed
CN-109678923-B Tripterine (iso) ferulic acid ester derivative and preparation method and application thereof 中国药科大学 2021-04-27 CN disclosed
CN-111073469-A Anti-yellowing powder coating for architectural decoration 王磊 2020-04-28 CN disclosed
US-9181186-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-11-10 US disclosed
US-20150045378-A1 AROMATIC RING COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-02-12 US disclosed
EP-2816032-A1 AROMATIC RING COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-12-24 EP disclosed
US-8304017-B2 Method of producing a patterned birefringent product FUJIFILM CORPORATION (JP) 2012-11-06 US disclosed
EP-0889877-A1 META-SUBSTITUTED PHENYLENE DERIVATIVES AND THEIR USE AS ALPHAvBETA3 INTEGRIN ANTAGONISTS OR INHIBITORS G.D. SEARLE & CO. (US) 1999-01-13 EP disclosed
US-5852210-A Cinnamic acid derivatives G. D. SEARLE & CO. (US) 1998-12-22 US disclosed
EP-0882029-A1 HETEROCYCLIC DERIVATIVES AS ANTIDIABETIC AND ANTIOBESITY AGENTS Merck & Co., Inc. (US) 1998-12-09 EP disclosed
US-5773646-A INTEGRIN INHIBITORS G. D. SEARLE & CO. (US) 1998-06-30 US disclosed
WO-1997048676-A1 TRIPHENYLALKYL ANTIMICROBIAL AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1997-12-24 WO disclosed
WO-1997036860-A1 CINNAMIC ACID DERIVATIVES AND THEIR USE AS INTEGRIN ANTAGONISTS G.D. SEARLE & CO. (US) 1997-10-09 WO disclosed
WO-1997036862-A1 META-SUBSTITUTED PHENYLENE DERIVATIVES AND THEIR USE AS ALPHAvBETA3 INTEGRIN ANTAGONISTS OR INHIBITORS G.D. SEARLE & CO. (US) 1997-10-09 WO disclosed
WO-1997028137-A1 HETEROCYCLIC DERIVATIVES AS ANTIDIABETIC AND ANTIOBESITY AGENTS MERCK & CO., INC. (US) 1997-08-07 WO disclosed
US-5643950-A INHIBITORS OF A BACTERIAL HISTIDINE PROTEIN KINASE ORTHO PHARMACEUTICAL CORPORATION (US) 1997-07-01 US disclosed
US-4117234-A DERIVATIVES OF 2-(6-PHENYLHEX-3-ENYL)-CYCLOPENT-2-EN-1-OL THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1978-09-26 US 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-20150045378-A1 AROMATIC RING COMPOUND GPR119, GPR27, GPR4 CA12 4521/4885CA1 4692/4885CA2 2214/4885
US-11725007-B2 Meta tyrosine derivatives as rho-kinase inhibitors ROCK1, ROCK2, RHOA CA12 4109/4885CA1 4180/4885CA2 813/4885

“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.