SCHEMBL8987306

SCHEMBL8987306

Cc1csc(C=CC(=O)c2ccccc2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.55
ALDH1A1 P00352 5/20 0.55
HPGD P15428 3/20 0.55
CYP3A4 P08684 2/20 0.55
CYP1B1 Q16678 2/20 0.51
LMNA P02545 4/20 0.50
RECQL P46063 2/20 0.50
PLIN1 O60240 1/20 0.50
BCHE P06276 1/20 0.50
TNFRSF1A P19438 1/20 0.50
ACHE P22303 1/20 0.50
MAOB P27338 1/20 0.50
PLIN5 Q00G26 1/20 0.50
ABHD5 Q8WTS1 1/20 0.50
RAB9A P51151 4/20 0.47
KMT2A Q03164 4/20 0.47
NPC1 O15118 3/20 0.47
MEN1 O00255 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NFKB1 P19838 2/20 0.47

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
SCHEMBL11473283 0.81 BCHE (0.58) MAPTALDH1A1CYP3A4CYP1B1LMNA
SCHEMBL1463003 0.80 HCAR2 (0.47) MAPTALDH1A1HPGDCYP3A4LMNA
SCHEMBL1463002 0.80 HCAR2 (0.47) MAPTALDH1A1HPGDCYP3A4LMNA
SCHEMBL18551797 0.79 MAPT (0.55) MAPTALDH1A1HPGDCYP3A4RECQL
SCHEMBL28984309 0.79 TNFRSF1A (0.43) ALDH1A1TNFRSF1AMAOBKDM4E
SCHEMBL14492801 0.78 KRAS (0.49) MAPTALDH1A1HPGDLMNAMAOB
SCHEMBL8948187 0.76 DAO (0.42) MAPTALDH1A1LMNARAB9AKMT2A
SCHEMBL13305777 0.76 DAO (0.42) MAPTALDH1A1LMNARAB9AKMT2A
SCHEMBL609542 0.76 JUN (0.54) MAPTALDH1A1TNFRSF1ARAB9ANPC1
SCHEMBL7842240 0.75 AKR1C1 (0.50) MAPTALDH1A1LMNAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5492915-A ANTIINFLAMMATORY AGENTS RHONE-POULENC RORER S.A. (FR) 1996-02-20 US disclosed
US-5366982-A Antiinflammatory agents or antihistamines RHONE-POULENC RORER S.A. (FR) 1994-11-22 US disclosed
EP-0540604-A1 SUBSTITUTED BICYCLIC BIS-ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B 4? ANTAGONIST ACTIVITY, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS Aventis Pharma S.A. (FR) 1993-05-12 EP disclosed
WO-1992001675-A2 SUBSTITUTED BICYCLIC BIS-ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B4 ANTAGONIST ACTIVITY, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS RHONE-POULENC RORER S.A. (FR) 1992-02-06 WO disclosed