SCHEMBL8567748

SCHEMBL8567748

O=C(OC#Cc1ccc(O)c(C23CC4CC(CC(C4)C2)C3)c1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 7/20 0.47
RARA P10276 6/20 0.47
RARG P13631 5/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
ALOX12 P18054 1/20 0.46
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
IKBKB O14920 2/20 0.43
THRB P10828 1/20 0.41
RECQL P46063 1/20 0.41
NR2E1 Q9Y466 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
SCHEMBL8567725 0.86 RARA (0.52) RARBRARARARGMEN1KMT2A
SCHEMBL8567959 0.82 FAAH (0.43) RARBRARARARGMEN1KMT2A
SCHEMBL8570955 0.81 RARA (0.40) RARBRARARARGMEN1KMT2A
SCHEMBL8566041 0.81 PDE4B (0.40) RARBRARARARGMEN1KMT2A
SCHEMBL8572597 0.80 HIF1A (0.48) RARBRARARARGMEN1KMT2A
SCHEMBL8570618 0.80 HIF1A (0.38) RARBRARARARGMEN1KMT2A
SCHEMBL8568934 0.80 RARA (0.41) RARBRARARARGMEN1KMT2A
SCHEMBL6378001 0.79 RARA (0.65) RARBRARARARGMEN1KMT2A
SCHEMBL8567780 0.79 CNR2 (0.43) RARBRARARARGMEN1KMT2A
SCHEMBL8566865 0.79 CNR2 (0.43) RARBRARARARGMEN1KMT2A

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-5798354-A COSMETIC, THERAPY CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-08-25 US claimed
US-5798354-A COSMETIC, THERAPY CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-08-25 US disclosed