SCHEMBL9622370

SCHEMBL9622370

O=C(O)c1ccc(CC(O)c2ccc(OCC34CC5CC(CC(C5)C3)C4)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXRA P19793 4/20 0.44
RXRB P28702 4/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP26A1 O43174 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP26B1 Q9NR63 1/20 0.42
EPHX2 P34913 5/20 0.41
FAAH O00519 1/20 0.41
CNR2 P34972 1/20 0.41
SCN9A Q15858 1/20 0.40
NR4A2 P43354 2/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SRD5A2 P31213 1/20 0.38

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
SCHEMBL9622587 0.88 SRD5A2 (0.49) RXRARXRBMEN1KMT2ACYP26A1
SCHEMBL420844 0.86 MEN1 (0.48) MEN1KMT2ACYP26A1CYP3A4CYP26B1
Hydrochloric Acid SCHEMBL9453210 0.85 MEN1 (0.47) MEN1KMT2ACYP26A1CYP3A4CYP26B1
SCHEMBL9622664 0.82 SRD5A2 (0.49) MEN1KMT2AEPHX2FAAHCNR2
SCHEMBL23009815 0.80 PKM (0.44) MEN1KMT2ACYP26A1CYP3A4CYP26B1
SCHEMBL2387597 0.73 PKM (0.53) MEN1KMT2AEPHX2FAAHCNR2
SCHEMBL9622366 0.71 RARB (0.59) MEN1KMT2ACYP26A1CYP3A4CYP26B1
SCHEMBL2748283 0.71 EPHX2 (0.60) MEN1KMT2AEPHX2NPC1RAB9A
SCHEMBL8056506 0.71 MEN1 (0.59) MEN1KMT2AEPHX2
SCHEMBL19149733 0.71 HIF1A (0.46) MEN1KMT2ANR4A2RAB9A

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
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