SCHEMBL664900

SCHEMBL664900

O=C(O)C(Cl)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.56
CYP2D6 P10635 1/20 0.56
LMNA P02545 5/20 0.54
MAPK1 P28482 2/20 0.54
TSHR P16473 1/20 0.50
CES2 O00748 2/20 0.46
CES1 P23141 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HPGD P15428 2/20 0.44
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43

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
SCHEMBL5325296 1.00 SRC (0.56) SRCCYP2D6LMNAMAPK1TSHR
Ammonia Solution, Strong SCHEMBL38660871 0.97 SRC (0.54) SRCCYP2D6LMNAMAPK1TSHR
Hydrochloric Acid SCHEMBL6334096 0.97 SRC (0.54) SRCCYP2D6LMNAMAPK1TSHR
Benzene SCHEMBL27730624 0.89 CYP2D6 (0.46) SRCCYP2D6LMNAMAPK1TSHR
SCHEMBL11839188 0.86 PTGS2 (0.59) SRCCYP2D6LMNATSHRMAPT
SCHEMBL9181806 0.84 CYP2D6 (0.50) SRCCYP2D6LMNAMAPK1TSHR
SCHEMBL286907 0.82 CYP2D6 (0.48) SRCCYP2D6LMNAMAPK1TSHR
SCHEMBL9823813 0.82 CYP2D6 (0.48) SRCCYP2D6LMNAMAPK1TSHR
SCHEMBL1173291 0.82 CYP2D6 (0.48) SRCCYP2D6LMNAMAPK1TSHR
SCHEMBL6960854 0.82 CYP2D6 (0.48) SRCCYP2D6LMNAMAPK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114752005-B Novel method for recycling organic photocatalyst in polymerization reaction 中国药科大学 2024-04-09 CN claimed
US-20230416252-A1 PROCESS TOWARD THE MANUFACTURE OF (6R,10S)-10-{4-[5-CHLORO-2-(4-CHLORO-1H-1,2,3-TRIAZOL-1-YL)PHENYL]-6-OXO-1(6H)-PYRIMIDINYL}- 1-(DIFLUOROMETHYL)-6-METHYL-1,4,7,8,9,10-HEXAHYDRO-11,15-(METHENO)PYRAZOLO[4,3-B][1,7]DIAZACYCLOTETRADECIN-5(6H)-ONE JANSSEN PHARMACEUTICA NV (BE) 2023-12-28 US claimed
CN-117120418-A Process for the preparation of compound (I) 百时美施贵宝公司 2023-11-24 CN claimed
EP-4225757-A1 A PROCESS TOWARD THE MANUFACTURE OF (6R,10S)-10-{4-[5-CHLORO-2-(4-CHLORO-1H-1,2,3-TRIAZOL-1-YL)PHENYL]-6-OXO-1(6H)-PYRIMIDINYL}-1-(DIFLUOROMETHYL)-6-METHYL-1,4,7,8,9,10-HEXAHYDRO-11,15-(METHENO)PYRAZOLO[4,3-B] [1,7]DIAZACYCLOTETRADECIN-5(6H)-ONE Bristol-Myers Squibb Company (US) 2023-08-16 EP claimed
WO-2023137518-A1 PLATINUM COMPLEXES Western Sydney University (AU) 2023-07-27 WO claimed
CN-116283894-A Synthesis method of vinyl sulfate 营口昌成新材料科技有限公司 2023-06-23 CN claimed
CN-111004137-B Synthesis method of racemic phenylglycine 浙江云涛生物技术股份有限公司 2022-08-05 CN claimed
CN-114752005-A Novel method for recovering organic photocatalyst in polymerization reaction 中国药科大学 2022-07-15 CN claimed
WO-2022081473-A1 A PROCESS TOWARD THE MANUFACTURE OF (6R,10S)-10-{4-[5-CHLORO-2-(4-CHLORO-1H-1,2,3-TRIAZOL-1-YL)PHENYL]-6-OXO-1(6H)-PYRIMIDINYL}-1-(DIFLUOROMETHYL)-6-METHYL-1,4,7,8,9,10-HEXAHYDRO-11,15-(METHENO)PYRAZOLO[4,3-B] [1,7]DIAZACYCLOTETRADECIN-5(6H)-ONE BRISTOL-MYERS SQUIBB COMPANY (US) 2022-04-21 WO claimed
CN-111704538-A Method for preparing p-hydroxyphenylacetic acid by using microreactor 杭州迈科瑞科技有限公司 2020-09-25 CN claimed
US-5137981-A Heat resistant rubber; esterification butadiene polymer using halogenated carboxy compound BRIDGESTONE CORPORATION (JP) 1992-08-11 US claimed
EP-0328291-B1 HALOGENATED POLYBUTADIENE SERIES ELASTOMERS, METHOD OF PRODUCING THE SAME, AND RUBBER COMPOSITIONS FOR TIRES CONTAINING THE ELASTOMER Bridgestone Corporation (JP) 1992-04-29 EP claimed
EP-0328291-A1 Halogenated polybutadiene series elastomers, method of producing the same, and rubber compositions for tires containing the elastomer Bridgestone Corporation (JP) 1989-08-16 EP claimed
US-4720494-A Anticholinergic eucatropine esters and antiperspirant use thereof THE GILLETTE COMPANY (US) 1988-01-19 US claimed
EP-0099802-B1 THIENO(3,2-C) PYRIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR THERAPEUTICAL USE ELF SANOFI (FR) 1987-02-04 EP claimed
EP-0034394-B1 PROCESS FOR THE PREPARATION OF 3'-BROMOSUBSTITUTED DEACETOXYCEPHALOSPORANIC ACID SULPHOXIDE DERIVATIVES GIST-BROCADES N.V. (NL) 1984-08-01 EP claimed
EP-0099802-A1 Thieno(3,2-c) pyridine derivatives, process for their preparation and their therapeutical use ELF SANOFI (FR) 1984-02-01 EP claimed
US-4366315-A Process for preparing 3'bromo-desacetoxycephalosporanic acid sulfoxide compounds GIST-BROCADES N.V. (NL) 1982-12-28 US claimed
EP-0034394-A2 Process for the preparation of 3'-bromosubstituted deacetoxycephalosporanic acid sulphoxide derivatives GIST-BROCADES N.V. (NL) 1981-08-26 EP claimed
US-4084061-A REARRANGEMENT OF TOLYL OR CHLOROTOLYL SODIUM, CARBOXYLATION IHARA CHEMICAL INDUSTRY CO., LTD. (JA) 1978-04-11 US 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 (1 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-20230416252-A1 PROCESS TOWARD THE MANUFACTURE OF (6R,10S)-10-{4-[5-CHLORO-2-(4-CHLORO-1H-1,2,3-TRIAZOL-1-YL)PHENYL]-6-OXO-1(6H)-PYRIMIDINYL}- 1-(DIFLUOROMETHYL)-6-METHYL-1,4,7,8,9,10-HEXAHYDRO-11,15-(METHENO)PYRAZOLO[4,3-B][1,7]DIAZACYCLOTETRADECIN-5(6H)-ONE CYP1B1, AZI2, TET1 SRC 2134/4885CYP2D6 8/4885LMNA 4356/4885

“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.