SCHEMBL29564370

SCHEMBL29564370

COC[C@]12CCC(O)CC1CC[C@@H]1[C@@H]2CC[C@]2(C)C(OC)CC[C@@H]12

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.51
▸ GPBAR1 Q8TDU6 2/20 0.51
▸ CYP1A2 P05177 2/20 0.51
▸ CYP3A4 P08684 2/20 0.51
▸ CYP2C9 P11712 2/20 0.51
▸ TSHR P16473 2/20 0.51
▸ SHBG P04278 1/20 0.51
▸ SERPINA6 P08185 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ G6PD P11413 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ PMP22 Q01453 1/20 0.46
▸ KMT2A Q03164 1/20 0.46

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
SCHEMBL15837577 1.00 LMNA (0.51) LMNAGPBAR1CYP1A2CYP3A4CYP2C9
SCHEMBL15838019 1.00 LMNA (0.51) LMNAGPBAR1CYP1A2CYP3A4CYP2C9
SCHEMBL15953333 1.00 LMNA (0.51) LMNAGPBAR1CYP1A2CYP3A4CYP2C9
SCHEMBL15953331 1.00 LMNA (0.51) LMNAGPBAR1CYP1A2CYP3A4CYP2C9
SCHEMBL20081182 1.00 LMNA (0.51) LMNAGPBAR1CYP1A2CYP3A4CYP2C9
SCHEMBL18950382 1.00 LMNA (0.51) LMNAGPBAR1CYP1A2CYP3A4CYP2C9
SCHEMBL15959577 0.89 LMNA (0.52) LMNAGPBAR1CYP1A2CYP3A4CYP2C9
SCHEMBL15837753 0.89 LMNA (0.52) LMNAGPBAR1CYP1A2CYP3A4CYP2C9
SCHEMBL15959585 0.89 LMNA (0.52) LMNAGPBAR1CYP1A2CYP3A4CYP2C9
SCHEMBL15959419 0.89 LMNA (0.52) LMNAGPBAR1CYP1A2CYP3A4CYP2C9

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
CN-114605486-A Neuroactive steroids, prodrugs thereof, and methods of treatment using the same 华盛顿大学 2022-06-10 — — CN disclosed
CN-109970833-B Neuroactive steroids, prodrugs thereof, and methods of treatment using the same 华盛顿大学 2022-05-27 — — CN disclosed
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