SCHEMBL9622083

SCHEMBL9622083

Cc1ccc2cc(C(=O)c3ccc(Oc4ccccc4)cc3)ccc2c1C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 6/20 0.54
POLB P06746 1/20 0.47
NR1H4 Q96RI1 1/20 0.45
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 1/20 0.43
DHODH Q02127 1/20 0.42
BCL2 P10415 3/20 0.42
MCL1 Q07820 3/20 0.42
BAD Q92934 1/20 0.42
ENPP2 Q13822 1/20 0.42
PARP10 Q53GL7 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
SCHEMBL9622132 0.87 KDM4E (0.51) POLBMEN1NPC1RAB9AKMT2A
SCHEMBL10424447 0.84 KDM4E (0.59) MEN1NPC1KMT2AALDH1A1
SCHEMBL8707349 0.84 ALDH1A1 (0.45) SRD5A2POLBMEN1NPC1RAB9A
SCHEMBL9502109 0.82 SRD5A2 (0.72) SRD5A2POLBMEN1NPC1RAB9A
SCHEMBL8461109 0.80 SRD5A2 (0.77) SRD5A2POLBNR1H4MEN1NPC1
SCHEMBL9622665 0.79 SRD5A2 (0.54) SRD5A2NR1H4MEN1NPC1RAB9A
SCHEMBL13465507 0.79 SRD5A2 (0.68) SRD5A2POLBMEN1NPC1RAB9A
SCHEMBL11591905 0.79 PTPN1 (0.50) MEN1NPC1RAB9AKMT2AALDH1A1
SCHEMBL1406448 0.77 CTSA (0.44) POLBMEN1NPC1KMT2AALDH1A1
SCHEMBL10540302 0.75 RARB (0.57)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5023363-A Antiinflammatory agent, antiallergens, skin disorders, vision defects L'OREAL (FR) 1991-06-11 US claimed
US-5093516-A AROMATIC COMPOUNDS, A PROCESS FOR THEIR PREPARATION AND THEIR USE IN HUMAN AND VETERINARY MEDICINE AND FOR COSMETIC COMPOSITIONS L'OREAL (FR) 1992-03-03 US disclosed
US-5023363-A Antiinflammatory agent, antiallergens, skin disorders, vision defects L'OREAL (FR) 1991-06-11 US disclosed