SCHEMBL11877459

SCHEMBL11877459

C[C@]12CCC(=O)C=C1CC[C@@H]1[C@H]2C(F)C[C@]2(C)C(O)CC[C@@H]12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.66
▸ CYP19A1 P11511 5/20 0.66
▸ AR P10275 5/20 0.66
▸ HSD17B10 Q99714 4/20 0.66
▸ CYP3A4 P08684 4/20 0.66
▸ SHBG P04278 3/20 0.66
▸ SERPINA6 P08185 3/20 0.66
▸ TSHR P16473 3/20 0.66
▸ SIGMAR1 Q99720 3/20 0.66
▸ NR3C1 P04150 2/20 0.66
▸ PGR P06401 2/20 0.66
▸ SNCA P37840 2/20 0.66
▸ CACNA1C Q13936 2/20 0.66
▸ CYP51A1 Q16850 2/20 0.66
▸ GPBAR1 Q8TDU6 2/20 0.66
▸ MAPT P10636 2/20 0.66
▸ MAPK1 P28482 2/20 0.66
▸ OR51E2 Q9H255 1/20 0.66
▸ HSD11B2 P80365 3/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.61

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
SCHEMBL11877453 1.00 LMNA (0.66) LMNACYP19A1ARHSD17B10CYP3A4
SCHEMBL619054 0.88 SMN1; SMN2 (0.76) LMNACYP19A1ARHSD17B10CYP3A4
SCHEMBL10185506 0.88 SMN1; SMN2 (0.76) LMNACYP19A1ARHSD17B10CYP3A4
SCHEMBL3362406 0.88 SMN1; SMN2 (0.76) LMNACYP19A1ARHSD17B10CYP3A4
SCHEMBL619055 0.88 SMN1; SMN2 (0.76) LMNACYP19A1ARHSD17B10CYP3A4
SCHEMBL24900243 0.88 SMN1; SMN2 (0.76) LMNACYP19A1ARHSD17B10CYP3A4
SCHEMBL14525631 0.88 SMN1; SMN2 (0.76) LMNACYP19A1ARHSD17B10CYP3A4
SCHEMBL20058468 0.88 SMN1; SMN2 (0.76) LMNACYP19A1ARHSD17B10CYP3A4
SCHEMBL15920491 0.88 SMN1; SMN2 (0.76) LMNACYP19A1ARHSD17B10CYP3A4
SCHEMBL20058563 0.88 SMN1; SMN2 (0.76) LMNACYP19A1ARHSD17B10CYP3A4

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-3966713-A 11β-FLUOROANDROSTENES SCHERING AKTIENGESELLSCHAFT (DT) 1976-06-29 — — US claimed
US-3966713-A 11β-FLUOROANDROSTENES SCHERING AKTIENGESELLSCHAFT (DT) 1976-06-29 — — US disclosed
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