SCHEMBL7316282

SCHEMBL7316282

OCc1cc(Cl)cc(OCc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.54
CYP4F2 P78329 1/20 0.53
CYP4A11 Q02928 1/20 0.53
TSHR P16473 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
LMNA P02545 1/20 0.49
CYP1A2 P05177 1/20 0.49
PTGS1 P23219 1/20 0.49
SLC6A2 P23975 1/20 0.49
CYP2C19 P33261 1/20 0.49
PTGS2 P35354 1/20 0.49
SLC6A3 Q01959 1/20 0.49
HIF1A Q16665 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
RXRA P19793 2/20 0.47
RXRB P28702 2/20 0.47
RXRG P48443 2/20 0.47
ALOX5 P09917 1/20 0.46

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
SCHEMBL3271153 0.88 CYP4F2 (0.61) CYP4F2CYP4A11TSHRSMN1; SMN2MEN1
SCHEMBL4910012 0.88 MEN1 (0.62) CYP4F2CYP4A11TSHRSMN1; SMN2MEN1
SCHEMBL14601810 0.86 MEN1 (0.61) CYP4F2CYP4A11TSHRSMN1; SMN2MEN1
SCHEMBL1842452 0.86 MEN1 (0.59) MRGPRX4CYP4F2CYP4A11SMN1; SMN2MEN1
SCHEMBL4933216 0.86 MRGPRX4 (0.63) MRGPRX4CYP4F2CYP4A11SMN1; SMN2MEN1
SCHEMBL2808909 0.83 GPBAR1 (0.58) CYP4F2CYP4A11TSHRSMN1; SMN2MEN1
SCHEMBL29142397 0.83 CYP1A2 (0.58) MRGPRX4CYP4F2CYP4A11MEN1KMT2A
SCHEMBL135152 0.83 LTB4R (0.57) MRGPRX4MEN1KMT2ARXRARXRB
SCHEMBL12221468 0.83 APP (0.49) SMN1; SMN2MAOB
SCHEMBL9454030 0.80 GRM5 (0.54) CYP4F2CYP4A11TSHRSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6441017-B1 Inhibitors of prenyl-protein transferase MERCK & CO., INC. 2002-08-27 US disclosed
EP-1214326-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2002-06-19 EP disclosed
WO-2001018006-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-03-15 WO disclosed
US-5376655-A Elastase inhibitor ONO PHARMACEUTICAL CO., LTD. (JP) 1994-12-27 US disclosed
US-5247084-A Inhibitors of elastase ONO PHARMACEUTICAL CO., LTD. (JP) 1993-09-21 US disclosed
US-5077428-A Antiinflammatory agents ONO PHARMACEUTICAL CO., LTD. (JP) 1991-12-31 US disclosed
EP-0222608-B1 DERIVATIVES OF P-GUANIDINOBENZOIC ACID AND PHARMACEUTICAL AGENTS CONTAINING THEM AS ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 1991-09-11 EP disclosed
US-4975464-A ADMINISTERING DERIVATIVES OF P-GUANIDINOBENZOIC ACID IMAKI KATSUHIRO (JP) 1990-12-04 US disclosed
US-4843094-A ELASTASE INHIBITOR ONO PHARMACEUTICAL CO., LTD. (JP) 1989-06-27 US disclosed