SCHEMBL5492913

SCHEMBL5492913

Cc1ccc(C)c(C(Cl)Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.42
ALDH1A1 P00352 3/20 0.42
CYP1A2 P05177 2/20 0.38
CYP2A6 P11509 2/20 0.38
TP53 P04637 2/20 0.37
LMNA P02545 3/20 0.37
TRPA1 O75762 1/20 0.37
CHRM1 P11229 1/20 0.37
SLC6A2 P23975 1/20 0.37
ADRA1A P35348 1/20 0.37
HTR2B P41595 1/20 0.37
TAAR1 Q96RJ0 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
HSD11B1 P28845 1/20 0.35
RAPGEF4 Q8WZA2 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL30644701 1.00 TDP1 (0.42) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL30033057 0.85 TDP1 (0.42) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL11616021 0.85 TDP1 (0.42) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL5953148 0.83 ALDH1A1 (0.41) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL5598397 0.80 TDP1 (0.42) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL27879984 0.78 CYP3A4 (0.48) TDP1ALDH1A1CYP2A6TP53LMNA
SCHEMBL598624 0.77 LMNA (0.54) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL30165955 0.77 LMNA (0.54) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL11882816 0.77 ALDH1A1 (0.44) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL28750861 0.76 CYP2A6 (0.35) TDP1ALDH1A1CYP1A2CYP2A6TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114057540-B Method for preparing 2, 5-dimethyl benzyl chloride 西安凯立新材料股份有限公司 2023-11-10 CN claimed
CN-104876292-A Method for treating high-concentration ammonia nitrogen in urea UNIV CHANGZHOU 2015-09-02 CN claimed
CN-102585312-B Nitrile rubber material for oil-resistant sealing element and preparation method thereof WUHU RONGJI SEALING SOLUTIONS CO LTD 2013-10-23 CN claimed
CN-102585314-B Oil-resistant sealing element rubber material and preparation method thereof WUHU RONGJI SEALING SOLUTIONS CO LTD 2013-10-23 CN claimed
CN-102952514-A Polydiphenyl oxide adhesive preparation method SU ZHOU 2013-03-06 CN claimed
US-6831111-B1 New or recycled Polystyrene and copolymers processed to become macroreticular, structure designed to absorb organic solvents and oil molecularly; crosslinked with 1,4-dichloromethyl-2,5-dichloromethyl-2,5- dimethylbenzene INNOVAL MANAGEMENT LIMITED (AN) 2004-12-14 US claimed
EP-1025135-B1 METHOD OF PREPARATION OF PRODUCTS WHICH ABSORB WATER INTRAMOLECULARLY INNOVAL MAN LTD (AN) 2004-09-29 EP claimed
EP-0902795-B1 METHOD AND PRODUCTS TO ABSORB OIL AND ORGANIC SOLVENTS FROM WATER AND FROM SEA INNOVAL MAN LTD (AN) 2002-12-04 EP claimed
US-6476152-B1 Method of preparation of products which absorb water intermolecularly INNOVAL MANAGEMENT, LTD. (NL) 2002-11-05 US claimed
EP-1025135-A1 METHOD OF PREPARATION OF PRODUCTS WHICH ABSORB WATER INTERMOLECULARLY Innoval Management Limited (AN) 2000-08-09 EP claimed
WO-1999021897-A1 METHOD OF PREPARATION OF PRODUCTS WHICH ABSORB WATER INTERMOLECULARLY INNOVAL MANAGEMENT LIMITED (AN) 1999-05-06 WO claimed
EP-0902795-A1 METHOD AND PRODUCTS TO ABSORB OIL AND ORGANIC SOLVENTS FROM WATER AND FROM SEA Innoval Management Limited (AN) 1999-03-24 EP claimed
WO-1997046595-A1 METHOD AND PRODUCTS TO ABSORB OIL AND ORGANIC SOLVENTS FROM WATER AND FROM SEA INNOVAL MANAGEMENT LIMITED (AN) 1997-12-11 WO claimed
JP-2229136-A None JP disclosed
CN-114057540-B Method for preparing 2, 5-dimethyl benzyl chloride 西安凯立新材料股份有限公司 2023-11-10 CN disclosed
CN-114057540-B Method for preparing 2, 5-dimethyl benzyl chloride 西安凯立新材料股份有限公司 2023-11-10 CN disclosed
WO-1999021897-A1 METHOD OF PREPARATION OF PRODUCTS WHICH ABSORB WATER INTERMOLECULARLY INNOVAL MANAGEMENT LIMITED (AN) 1999-05-06 WO disclosed
CN-1213672-A Synthetizing of poly-p-phenylacetylene INST OF MILITARY MEDICINE REAR (CN) 1999-04-14 CN disclosed
JP-H02229136-A ORGANIC LIQUID CRYSTAL COMPOUND MITSUBISHI PETROCHEM CO LTD 1990-09-11 JP disclosed
EP-0176292-A2 Aromatic polymers NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1986-04-02 EP disclosed