SCHEMBL8304982

SCHEMBL8304982

Cc1cc(C(=O)c2ccccc2)ccc1SCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
AR P10275 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.43
KMT2A Q03164 1/20 0.43
PTPRC P08575 1/20 0.42
LMNA P02545 4/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
ACHE P22303 1/20 0.42
SRD5A2 P31213 1/20 0.42
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
ALDH1A1 P00352 2/20 0.41
NPC1 O15118 1/20 0.41
MITF O75030 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL7895923 0.82 ACHE (0.48) L3MBTL1ATMTDP1ARMRGPRX4
SCHEMBL7814224 0.82 AR (0.59) L3MBTL1ATMTDP1ARMRGPRX4
SCHEMBL7810437 0.78 HAO1 (0.46) KMT2ALMNAKDM4EMAPTACHE
SCHEMBL7814223 0.77 CNR2 (0.53) L3MBTL1ATMTDP1KMT2AKDM4E
Methyl Alcohol SCHEMBL28161311 0.76 MAPK1 (0.54) L3MBTL1KMT2ALMNAMAPTHTT
SCHEMBL5315574 0.76 HAO1 (0.59) KMT2ALMNAKDM4ESRD5A2SMN1; SMN2
SCHEMBL7814092 0.75 ACHE (0.47) MRGPRX4KMT2ALMNAKDM4EMAPT
SCHEMBL7897148 0.75 AR (0.48) L3MBTL1TDP1ARMRGPRX4KMT2A
SCHEMBL11820078 0.75 MRGPRX4 (0.51) ARMRGPRX4LMNAHTTSMN1; SMN2
SCHEMBL8304985 0.74 LMNA (0.50) L3MBTL1ATMTDP1LMNAACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891345-A1 NOVEL FURAN DIARYLMETHYLIDENE DERIVATIVES, METHOD FOR THEIR PREPARATION AND THERAPEUTICAL USES THEREOF LABORATOIRES UPSA (FR) 1999-01-20 EP disclosed
WO-1997037984-A1 NOVEL FURAN DIARYLMETHYLIDENE DERIVATIVES, METHOD FOR THEIR PREPARATION AND THERAPEUTICAL USES THEREOF LABORATOIRES UPSA (FR) 1997-10-16 WO disclosed