SCHEMBL8653384

SCHEMBL8653384

COc1ccc([C@H]2C[C@]3(C)C(=O)CC[C@H]3[C@@H]3C[C@@H]4O[C@]45CC4(CC[C@@H]5[C@H]32)OCCO4)cc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HSD17B1 P14061 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CYP19A1 P11511 17/20 0.37
▸ POLB P06746 1/20 0.37
▸ NR3C1 P04150 1/20 0.33
▸ PGR P06401 1/20 0.33
▸ AR P10275 1/20 0.33

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
SCHEMBL8948757 0.89 MAPT (0.34) MAPTLMNAHSD17B1RECQLSMN1; SMN2
SCHEMBL8768970 0.85 PGR (0.33) CYP19A1NR3C1PGRAR
SCHEMBL8410289 0.84 PGR (0.32) NR3C1PGRAR
SCHEMBL8651638 0.83 MAPT (0.39) MAPTLMNAHSD17B1RECQLSMN1; SMN2
SCHEMBL9174063 0.83 MAPT (0.39) MAPTLMNAHSD17B1RECQLSMN1; SMN2
SCHEMBL8768139 0.83 MAPT (0.39) MAPTLMNAHSD17B1RECQLSMN1; SMN2
SCHEMBL8653835 0.76 MAPT (0.46) MAPTLMNAHSD17B1RECQLSMN1; SMN2
SCHEMBL8407083 0.73 CYP19A1 (0.37) MAPTLMNAHSD17B1RECQLSMN1; SMN2
SCHEMBL8655553 0.72 MAPT (0.35) MAPTLMNAHSD17B1RECQLSMN1; SMN2
SCHEMBL8654560 0.72 STS (0.38) MAPTLMNAHSD17B1RECQLSMN1; SMN2

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
EP-0567472-B1 D-HOMO-(16-EN)-11 BETA-ARYL-4-ESTRENES, PROCESS FOR PRODUCING THEM AND THEIR USE AS MEDICAMENTS SCHERING AG (DE) 1998-10-07 — — EP disclosed
US-5519027-A PROGESTERONE ANTAGONIST FOR OXYTOCICS OR PREVENTION OF TERMINATION OF PREGNANCY SCHERING AKTIENGESELLSCHAFT (DE) 1996-05-21 — — US disclosed
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