SCHEMBL3387244

SCHEMBL3387244

Cc1c(Cl)cccc1-n1ccnn1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 14/20 0.53
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CHRNB2 P17787 1/20 0.45
CYP2B6 P20813 1/20 0.45
MAOA P21397 1/20 0.45
CYP2C19 P33261 1/20 0.45
CHRNA4 P43681 1/20 0.45
HTR3A P46098 1/20 0.45
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
KEAP1 Q14145 1/20 0.40
RECQL P46063 1/20 0.40
HCAR1 Q9BXC0 1/20 0.38

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
SCHEMBL22702085 0.83 NOTUM (0.47) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL29471923 0.82 NOTUM (0.71) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL18378736 0.82 NOTUM (0.47) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL29842592 0.82 NOTUM (0.59) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL27531505 0.82 NOTUM (0.59) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL7111602 0.79 NOTUM (0.44) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL6428993 0.79 NOTUM (0.44) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL27613715 0.79 NOTUM (0.44) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL16983108 0.77 NOTUM (0.58) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL18367715 0.77 NOTUM (0.42) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100022424-A1 USE OF TRIAZOLES IN REDUCING COBALT LEACHING FROM COBALT-CONTAINING METAL WORKING TOOLS Wincom, Inc. (US) 2010-01-28 US claimed
US-6585933-B1 Method and composition for inhibiting corrosion in aqueous systems BETZDEARBORN, INC. 2003-07-01 US claimed
US-5773627-A MIXING SODIUM HYPOHALITE WITH AQUEOUS SLURRY OR SUSPENSION OF A BENZOTRIAZOLE BETZDEARBORN INC. (US) 1998-06-30 US claimed
US-5772919-A CORROSION RESISTANCE OF METALS IN AQUEOUS SYSTEMS AND WITH HALOGEN TREATMENT BETZDEARBORN INC. (US) 1998-06-30 US claimed
EP-4397631-A2 METHODS TO REDUCE N-HETEROCYCLES BL TECHNOLOGIES, Inc. (US) 2024-07-10 EP disclosed
CN-117923676-A Methods and compositions for reducing azole and AOX corrosion inhibitors BL 科技公司 2024-04-26 CN disclosed
CN-111801301-B Methods and compositions for reducing azole and AOX corrosion inhibitors BL 科技公司 2023-11-24 CN disclosed
US-20230331600-A1 METHODS AND COMPOSITIONS TO REDUCE AZOLES AND AOX CORROSION INHIBITORS BL TECHNOLOGIES, INC. 2023-10-19 US disclosed
US-11760666-B2 Methods and compositions to reduce azoles and AOX corrosion inhibitors BL TECHNOLOGIES, INC. (US) 2023-09-19 US disclosed
EP-3455394-B1 NITROGEN SUBSTITUTED AROMATIC TRIAZOLES AS CORROSION CONTROL AGENTS BL TECHNOLOGIES INC (US) 2023-04-05 EP disclosed
CN-110325603-B Method for preparing functional aqueous dispersions 巴斯夫欧洲公司 2022-10-14 CN disclosed
EP-3762339-A1 METHODS AND COMPOSITIONS TO REDUCE AZOLES AND AOX CORROSION INHIBITORS BL Technologies, Inc. (US) 2021-01-13 EP disclosed
US-5968408-A ODORLESS BETZDEARBORN INC. (US) 1999-10-19 US disclosed
US-5863463-A Methods of inhibiting corrosion using halo-benzotriazoles BETZDEARBORN INC. (US) 1999-01-26 US disclosed
US-5863463-A Methods of inhibiting corrosion using halo-benzotriazoles BETZDEARBORN INC. (US) 1999-01-26 US disclosed
US-5863464-A ADDING TO AN AQUEOUS SYSTEM TREATED WITH HALOGEN AN EFFECTIVE AMOUNT OF MONO OR DI-HALOBENZOTRIAZOLE CORROSION INHIBITOR OR ANTIDEPOSIT AGENT BETZDEARBORN INC. (US) 1999-01-26 US disclosed
US-5863464-A ADDING TO AN AQUEOUS SYSTEM TREATED WITH HALOGEN AN EFFECTIVE AMOUNT OF MONO OR DI-HALOBENZOTRIAZOLE CORROSION INHIBITOR OR ANTIDEPOSIT AGENT BETZDEARBORN INC. (US) 1999-01-26 US disclosed
US-5772919-A CORROSION RESISTANCE OF METALS IN AQUEOUS SYSTEMS AND WITH HALOGEN TREATMENT BETZDEARBORN INC. (US) 1998-06-30 US disclosed
US-5772919-A CORROSION RESISTANCE OF METALS IN AQUEOUS SYSTEMS AND WITH HALOGEN TREATMENT BETZDEARBORN INC. (US) 1998-06-30 US disclosed
US-5773627-A MIXING SODIUM HYPOHALITE WITH AQUEOUS SLURRY OR SUSPENSION OF A BENZOTRIAZOLE BETZDEARBORN INC. (US) 1998-06-30 US disclosed