SCHEMBL196040

SCHEMBL196040

COP(OC)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
CA4 P22748 2/20 0.41
ESR1 P03372 4/20 0.37
ESR2 Q92731 4/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
PDE4B Q07343 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
LMNA P02545 2/20 0.35
CDC25A P30304 2/20 0.35
CDC25B P30305 2/20 0.35
LTA4H P09960 2/20 0.35
MAPT P10636 2/20 0.35

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
Hydrochloric Acid SCHEMBL28639460 0.97 CYP3A4 (0.43) CYP3A4TDP1CA4ESR1ESR2
SCHEMBL30679662 0.97 CYP3A4 (0.43) CYP3A4TDP1CA4ESR1ESR2
SCHEMBL28403849 0.90 CYP3A4 (0.38) CYP3A4TDP1CA4ESR1ESR2
Perchlorate SCHEMBL11569414 0.88 CYP3A4 (0.42) CYP3A4TDP1CA4ESR1ESR2
SCHEMBL8939020 0.83 CA4 (0.44) CYP3A4TDP1CA4ESR1ESR2
SCHEMBL10792824 0.81 CYP3A4 (0.35) CYP3A4TDP1CA4ESR1ESR2
Pyridine SCHEMBL11208438 0.78 KDM4E (0.36) CYP3A4TDP1KDM4ETSHR
SCHEMBL10039485 0.77 ESR2 (0.33) ESR2SMN1; SMN2TP53RAB9AMAPK1
SCHEMBL187947 0.77 CYP3A4 (0.45) CYP3A4TDP1CA4ESR1ESR2
SCHEMBL2378857 0.74 CYP3A4 (0.43) CYP3A4TDP1CA4ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119930491-A Synthesis method of polysubstituted pyrrolidone 北京化工大学 2025-05-06 CN claimed
CN-119529521-A Graphene grafted flame retardant modified nylon 6 flame-retardant composite material and preparation method thereof 上海陛耀科技开发有限公司 2025-02-28 CN claimed
CN-118420667-A Triazinyl compound with flame retardant and light stability performance and preparation method thereof 宿迁联盛科技股份有限公司 2024-08-02 CN claimed
US-20230167144-A1 PREPARATION AND ITS APPLICATION OF A CYANIDE-BRIDGED METAL ORGANIC COMPOUND WITH INTRAMOLECULAR MAGNETIC TRANSFORMATION Hubei Jingmen Industrial Technology Research Institute Co., Ltd. (CN) 2023-06-01 US claimed
CN-109721508-B Method for preparing 3-pentenenitrile 安徽省安庆市曙光化工股份有限公司 2022-10-04 CN claimed
CN-114960227-A High-strength automobile cover plate and machining process thereof 常熟新常泰汽车内饰科技有限公司 2022-08-30 CN claimed
US-20220115694-A1 LITHIUM ION BATTERIES WITH HIGH VOLTAGE ELECTROLYTE ADDITIVES WILDCAT DISCOVERY TECHNOLOGIES, INC 2022-04-14 US claimed
CN-112920047-A Process for preparing 4-acetoxy-2-methyl-2-butene-1-aldehyde and intermediates thereof 江西天新药业股份有限公司 2021-06-08 CN claimed
CN-111518145-A Cyanide-bridged metal organic compound with intramolecular magnetic transformation, and preparation method and application thereof 荆楚理工学院 2020-08-11 CN claimed
CN-109721508-A A method of preparing 3 pentene nitrile 安徽省安庆市曙光化工股份有限公司 2019-05-07 CN claimed
US-7115790-B2 Method for the production of 1-octene by reductive telomerisation OXENO OLEFINCHEMIE GMBH (DE) 2006-10-03 US claimed
EP-0122735-B1 HIGH MOLECULAR WEIGHT POLYBENZIMIDAZOLE PRODUCTION CELANESE CORPORATION (US) 1987-11-25 EP claimed
EP-0095348-B1 HIGH MOLECULAR WEIGHT POLYBENZIMIDAZOLES CELANESE CORPORATION (US) 1986-04-09 EP claimed
EP-0122735-A2 High molecular weight polybenzimidazole production CELANESE CORPORATION (US) 1984-10-24 EP claimed
US-4463167-A Two stage high molecular weight polybenzimidazole production with phosphorus containing catalyst CELANESE CORPORATION (US) 1984-07-31 US claimed
EP-0095348-A2 High molecular weight polybenzimidazoles CELANESE CORPORATION (US) 1983-11-30 EP claimed
US-4414383-A High molecular weight polybenzimidazole preparation with phosphorus containing polymerization catalyst CELANESE CORPORATION (US) 1983-11-08 US claimed
EP-0001149-B1 PROCESS FOR THE PREPARATION OF 3-BROMOMETHYL-3-CEPHEM-SULPHOXIDE DERIVATIVES GIST-BROCADES N.V. (NL) 1981-06-03 EP claimed
US-4182870-A BROMINATION, DEBROMINATION GIST-BROCADES N.V. (NL) 1980-01-08 US claimed
EP-0001149-A1 Process for the preparation of 3-bromomethyl-3-cephem-sulphoxide derivatives GIST-BROCADES N.V. (NL) 1979-03-21 EP claimed