SCHEMBL23659

SCHEMBL23659

COC(=O)c1ccccc1Br

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.61
LMNA P02545 1/20 0.61
ALDH1A1 P00352 2/20 0.59
CFTR P13569 1/20 0.59
HSD17B10 Q99714 1/20 0.59
KDM4E B2RXH2 2/20 0.57
POLB P06746 2/20 0.57
ATM Q13315 1/20 0.57
KMT2A Q03164 6/20 0.56
MEN1 O00255 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA5A P35218 1/20 0.56
CA9 Q16790 1/20 0.56
SLC6A3 Q01959 2/20 0.56
MAPT P10636 4/20 0.52
ALOX15 P16050 1/20 0.52

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
SCHEMBL29433258 1.00 TSHR (0.61) TSHRLMNAALDH1A1CFTRHSD17B10
Bicarbonate SCHEMBL20918171 0.96 TSHR (0.57) TSHRLMNAALDH1A1CFTRHSD17B10
Carbon Monoxide SCHEMBL10629386 0.94 LMNA (0.55) TSHRLMNAALDH1A1CFTRHSD17B10
SCHEMBL29058049 0.89 TSHR (0.50) TSHRLMNAALDH1A1CFTRHSD17B10
SCHEMBL20918169 0.89 TSHR (0.50) TSHRLMNAALDH1A1CFTRHSD17B10
SCHEMBL15525214 0.84 SLC6A3 (0.63) TSHRLMNAALDH1A1CFTRHSD17B10
Dimethyl Phthalate SCHEMBL29669976 0.84 TSHR (0.74) TSHRLMNAALDH1A1CFTRHSD17B10
Dimethyl Phthalate SCHEMBL29500970 0.84 TSHR (0.74) TSHRLMNAALDH1A1CFTRHSD17B10
Dimethyl Phthalate SCHEMBL790124 0.84 TSHR (0.74) TSHRLMNAALDH1A1CFTRHSD17B10
Dimethyl Phthalate SCHEMBL34630 0.84 TSHR (0.74) TSHRLMNAALDH1A1CFTRHSD17B10

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 1820 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116854631-B 4-Aryl-2-pyridone compound and preparation method thereof 安徽中医药大学 2025-04-15 CN claimed
CN-119462532-A Near infrared material suitable for solution processing and preparation method and application thereof 广东工业大学 2025-02-18 CN claimed
CN-119306765-A Adamantyl phosphine ligand of cinchona alkaloid skeleton, silver catalyst containing ligand and application of ligand 浙江工业大学 2025-01-14 CN claimed
CN-117343037-B Spirofluorene naphthoxanthene organic blue light material and preparation method and application thereof 山东浩华新材料科技有限公司 2024-12-03 CN claimed
CN-117343037-A Spirofluorene naphthoxanthene organic blue light material and preparation method and application thereof 山东浩华新材料科技有限公司 2024-01-05 CN claimed
CN-116854631-A 4-aryl-2-pyridone compound and preparation method thereof 安徽中医药大学 2023-10-10 CN claimed
CN-112430177-B Synthesis method of montelukast sodium intermediate 凯特立斯(深圳)科技有限公司 2023-08-25 CN claimed
CN-111978200-B Biphenylamide derivative, preparation method and application 湖北省生物农药工程研究中心 2022-09-13 CN claimed
CN-114957312-A Aryl silicon compound of conjugated olefin and preparation method and application thereof 南京工业大学 2022-08-30 CN claimed
CN-114853795-A Arylboron compound of conjugated olefin and preparation method and application thereof 南京工业大学 2022-08-05 CN claimed
CN-101519411-B Method for preparing phenylboronic acid-2-methyl formate ASYMCHEM LAB TIANJIN CO LTD 2011-07-20 CN claimed
US-20110152481-A1 Internal and external donor compounds for olefin polymerization catalysts BASF CATALYSTS LLC (US) 2011-06-23 US claimed
US-7825201-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2010-11-02 US claimed
US-20090299019-A1 PROCESS FOR PRODUCING POLYDIENES BRIDGESTONE CORPORATION (JP) 2009-12-03 US claimed
CN-101519411-A Method for preparing phenylboronic acid-2-methyl formate KAILAIYING MEDICAL CHEMICAL TI 2009-09-02 CN claimed
CN-1240210-A Substituted tricyclic compound LILLY CO ELI (US) 2000-01-05 CN claimed
US-5159082-A Catalytic coupling of an aromatic sulfinic acid with an aromatic halogen compound MITSUBISHI KASEI CORPORATION (JP) 1992-10-27 US claimed
EP-0405389-A1 Process for producing an aromatic compound Mitsubishi Chemical Corporation (JP) 1991-01-02 EP claimed
EP-0070622-B1 DERIVATIVES OF M.139,603 USEFUL AS GROWTH PROMOTORS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-01-14 EP claimed
EP-0070622-A1 Derivatives of M.139,603 useful as growth promotors IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-01-26 EP claimed