SCHEMBL7920646

SCHEMBL7920646

O=C(O)c1ccc(-c2ccc3ccc(C45CC6CC(CC(C6)C4)C5)cc3c2OCCCCCCO)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.48
RARG P13631 9/20 0.48
RARA P10276 6/20 0.48
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42
NR1I2 O75469 1/20 0.42
LMNA P02545 1/20 0.42
PGR P06401 1/20 0.42
HSPD1 P10809 1/20 0.42

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
SCHEMBL7929851 0.93 RARB (0.45) RARBRARGRARAMEN1KMT2A
SCHEMBL7930122 0.90 HIF1A (0.43) RARBRARGRARAMEN1KMT2A
SCHEMBL7927690 0.89 RARB (0.43) RARBRARGRARAMEN1KMT2A
SCHEMBL7926559 0.88 RARB (0.44) RARBRARGRARAMEN1KMT2A
SCHEMBL8458430 0.85 HIF1A (0.41) RARBRARGRARAMEN1KMT2A
SCHEMBL7927824 0.84 HIF1A (0.43) RARBRARGRARAMEN1KMT2A
SCHEMBL7927274 0.81 HIF1A (0.40) RARBRARGRARAMEN1KMT2A
SCHEMBL7926544 0.79 HIF1A (0.39) RARBRARGRARAMEN1KMT2A
SCHEMBL8459706 0.77 PTPN11 (0.41) RARBRARGRARAMEN1KMT2A
SCHEMBL7929547 0.75 RARB (0.43) RARBRARGRARAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6225328-B1 FOR THERAPY OF DISORDERS OR AILMENTS RELATED TO AN OVERREGULATION OF RETINOIC ACID RECEPTORS AND/OR TO HYPERVIAMINOSIS A CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) 2001-05-01 US disclosed