SCHEMBL8437231

SCHEMBL8437231

COC(=O)c1ccc(-c2ccc3cc4c(cc3c2)C(c2ccc(OC)cc2)=CCC4(C)C)cc1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RARB P10826 16/20 0.66
RARG P13631 15/20 0.66
RARA P10276 14/20 0.66
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
PLAU P00749 1/20 0.41
RXRA P19793 1/20 0.41
NR2E1 Q9Y466 1/20 0.41
KMT2A Q03164 1/20 0.40

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
SCHEMBL8709424 0.91 RARB (0.63) RARBRARGRARARXRANR2E1
SCHEMBL8709506 0.91 RARB (0.80) RARBRARGRARARXRANR2E1
SCHEMBL6907265 0.86 RARB (0.64) RARBRARGRARACYP11B1CYP11B2
SCHEMBL8438952 0.85 RARB (0.56) RARBRARGRARACYP11B1CYP11B2
SCHEMBL8709650 0.84 CYP11B2 (0.58) RARBRARGRARACYP11B1CYP11B2
SCHEMBL7807072 0.81 RARA (0.64) RARBRARGRARARXRANR2E1
SCHEMBL7807061 0.81 RARA (0.60) RARBRARGRARACA1CA2
SCHEMBL7807064 0.81 RARA (0.64) RARBRARGRARARXRANR2E1
SCHEMBL8706490 0.81 RARB (0.85) RARBRARGRARARXRANR2E1
SCHEMBL8709537 0.80 RARB (0.84) RARBRARGRARARXRANR2E1

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-5945561-A ANTIINFLAMMATORY AGENT, RHEUMATIC DISORDERS, SKIN DISORDERS,ANTISCARRING AGENT BRISTOL-MYERS SQUIBB COMPANY (US) 1999-08-31 US disclosed
WO-1998049136-A1 RETINOID-LIKE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 1998-11-05 WO disclosed