SCHEMBL8458293

SCHEMBL8458293

COCCOCOc1cc(C23CC4CC(CC(C4)C2)C3)cc(-c2cccc3ccccc23)c1C(=O)Nc1ccc(O)cc1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 4/20 0.39
RARA P10276 2/20 0.39
HIF1A Q16665 7/20 0.36
EPAS1 Q99814 3/20 0.36
DEGS1 O15121 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 2/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
EGFR P00533 1/20 0.34

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
SCHEMBL8458404 0.92 HIF1A (0.38) IKBKBRARAHIF1AEPAS1MEN1
SCHEMBL8458292 0.87 IKBKB (0.41) IKBKBRARAHIF1AEPAS1KMT2A
SCHEMBL8458442 0.83 IKBKB (0.42) IKBKBRARAHIF1AEPAS1MEN1
SCHEMBL8458190 0.82 DEGS1 (0.35) HIF1AEPAS1DEGS1MEN1KMT2A
SCHEMBL8457350 0.74 EPHX2 (0.36) HIF1AEPAS1MEN1KMT2ANPC1
SCHEMBL8911209 0.72 RARA (0.41) RARAMEN1KMT2ANPC1RAB9A
SCHEMBL8394691 0.69 IKBKB (0.47) IKBKBRARAHIF1AEPAS1EGFR
SCHEMBL7929495 0.69 IKBKB (0.49) IKBKBRARAHIF1AEPAS1MEN1
SCHEMBL8424476 0.68 IKBKB (0.77) IKBKBRARAMEN1KMT2A
SCHEMBL8909355 0.68 MEN1 (0.42) IKBKBRARAMEN1KMT2APOLB

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-5952382-A INHIBITING THE BIOLOGICAL EFFECTS OF AN OVERREGULATION OF RETINOID ACID RECEPTORS AND/OR OF A HYPERVITAMINOSIS A; TREATING SKIN DISORDER, EYE VISION DEFECTS, SKIN AGING CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1999-09-14 US claimed
US-5952382-A INHIBITING THE BIOLOGICAL EFFECTS OF AN OVERREGULATION OF RETINOID ACID RECEPTORS AND/OR OF A HYPERVITAMINOSIS A; TREATING SKIN DISORDER, EYE VISION DEFECTS, SKIN AGING CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1999-09-14 US disclosed