SCHEMBL11877677

SCHEMBL11877677

CCCCOC1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@H]3C(F)C[C@]12C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 7/20 0.51
▸ CYP3A4 P08684 6/20 0.48
▸ TSHR P16473 4/20 0.48
▸ MAPT P10636 3/20 0.48
▸ NR3C1 P04150 3/20 0.48
▸ PGR P06401 3/20 0.48
▸ AR P10275 3/20 0.48
▸ CYP2C9 P11712 2/20 0.48
▸ NR1I2 O75469 1/20 0.48
▸ CYP17A1 P05093 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ OPRK1 P41145 1/20 0.48
▸ NR3C2 P08235 4/20 0.48
▸ HSD17B10 Q99714 4/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ HSD11B2 P80365 3/20 0.48
▸ HIF1A Q16665 3/20 0.48
▸ SHBG P04278 3/20 0.48
▸ SERPINA6 P08185 3/20 0.48
▸ SIGMAR1 Q99720 3/20 0.48

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
SCHEMBL11877669 1.00 LMNA (0.51) LMNACYP3A4TSHRMAPTNR3C1
SCHEMBL11872240 0.86 HSD11B2 (0.54) LMNACYP3A4TSHRMAPTNR3C1
SCHEMBL11872233 0.86 HSD11B2 (0.54) LMNACYP3A4TSHRMAPTNR3C1
SCHEMBL11871714 0.84 LMNA (0.74) LMNACYP3A4TSHRMAPTNR3C1
SCHEMBL11871865 0.84 LMNA (0.74) LMNACYP3A4TSHRMAPTNR3C1
SCHEMBL11224446 0.84 LMNA (0.74) LMNACYP3A4TSHRMAPTNR3C1
SCHEMBL11224438 0.84 LMNA (0.74) LMNACYP3A4TSHRMAPTNR3C1
SCHEMBL11871706 0.84 LMNA (0.74) LMNACYP3A4TSHRMAPTNR3C1
SCHEMBL11876565 0.83 CYP3A4 (0.71) LMNACYP3A4TSHRMAPTNR3C1
SCHEMBL11876574 0.83 CYP3A4 (0.71) LMNACYP3A4TSHRMAPTNR3C1

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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