SCHEMBL8345529

SCHEMBL8345529

O=C(Cl)c1ccc(O)c(Cl)c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SELL P14151 1/20 0.41
SELP P16109 1/20 0.41
MAPK1 P28482 2/20 0.41
CYP3A4 P08684 1/20 0.41
PIK3CA P42336 4/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
ALDH1A1 P00352 3/20 0.35
ALOX15 P16050 1/20 0.35
HDAC1 Q13547 1/20 0.35
TSHR P16473 2/20 0.34
CLCN2 P51788 1/20 0.34
SHBG P04278 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL1758276 0.84 HDAC1 (0.45) SELLSELPMAPK1CYP3A4PIK3CA
SCHEMBL28124327 0.84 MAPK1 (0.48) SELLSELPMAPK1CYP3A4PIK3CA
SCHEMBL28842145 0.84 SELL (0.48) SELLSELPMAPK1CYP3A4PIK3CA
SCHEMBL29941520 0.82 SELL (0.64) SELLSELPCYP3A4CA1CA2
SCHEMBL2649879 0.82 SELL (0.64) SELLSELPCYP3A4CA1CA2
SCHEMBL1616641 0.81 SELL (0.62) SELLSELPPIK3CAALDH1A1ALOX15
SCHEMBL30863510 0.81 SELL (0.62) SELLSELPPIK3CAALDH1A1ALOX15
SCHEMBL481034 0.80 MAPT (0.44) SELLSELPMAPK1CYP3A4PIK3CA
SCHEMBL19183435 0.80 KDM4E (0.45) SELLSELPMAPK1CYP3A4PIK3CA
SCHEMBL5298121 0.80 SELL (0.46) SELLSELPMAPK1CYP3A4PIK3CA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108752195-A A kind of new preparation process of 2,4- dihydroxybenzoyls chlorine 上海华堇生物技术有限责任公司 2018-11-06 CN disclosed
US-5936007-A ALPHA-ORGANOSULFONYL-OMEGA-ORGANOSULFONYL OR CARBONYLALKANES AS STABILIZERS; MEDICAL EQUIPMENT; DIALYSIS HOUSINGS; STEAM STERILIZABLE; DISCOLORATION INHIBITION; ODORLESS; HEAT AND RADIATION RESISTANT BAYER AG (DE) 1999-08-10 US disclosed
US-5852070-A (Co) polycarbonates stabilised against γ-radiation BAYER AG (DE) 1998-12-22 US disclosed
US-5852157-A Process for the production of polycarbonate agglomerate BAYER AKTIENGESELLSCHAFT (DE) 1998-12-22 US disclosed
US-5830977-A Process for the isolation of partially crystalline polycarbonate powder BAYER AKTIENGESELLSCHAFT (DE) 1998-11-03 US disclosed
US-5773491-A METHYLTHIAZOLIDINTHIONE OR METHYLBENZOTHIAZOLIDINTHIONE BAYER AG (DE) 1998-06-30 US disclosed
US-5684087-A HEAT EXCHANGING OR STRIPPING SOLVENTS FROM SOLUTIONS OF POLYMERS WITH STEAM FOR POLYMER PASTES, CLEANING AND HEATING BAYER AKTIENGESELLSCHAFT (DE) 1997-11-04 US disclosed