SCHEMBL11109164

SCHEMBL11109164

CC(=O)OCC(=O)[C@@]1(O)C(C)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SERPINA6 P08185 4/20 0.64
▸ LMNA P02545 5/20 0.60
▸ MEN1 O00255 4/20 0.60
▸ KMT2A Q03164 4/20 0.60
▸ SMN1; SMN2 Q16637 4/20 0.60
▸ ALDH1A1 P00352 3/20 0.60
▸ MAPT P10636 2/20 0.60
▸ CYP3A4 P08684 2/20 0.60
▸ AR P10275 5/20 0.59
▸ NR3C1 P04150 4/20 0.59
▸ BLM P54132 3/20 0.59
▸ TSHR P16473 3/20 0.59
▸ FNTA P49354 1/20 0.59
▸ FNTB P49356 1/20 0.59
▸ PGR P06401 4/20 0.58
▸ HIF1A Q16665 3/20 0.58
▸ CHRM1 P11229 2/20 0.58
▸ SHBG P04278 4/20 0.57
▸ CYP2C19 P33261 3/20 0.57
▸ ADORA3 P0DMS8 1/20 0.57

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
SCHEMBL11413691 1.00 SERPINA6 (0.64) SERPINA6LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9862493 0.88 HSD17B10 (0.71) SERPINA6LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9862485 0.88 HSD17B10 (0.71) SERPINA6LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9193196 0.86 FNTA (0.73) SERPINA6LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9193185 0.86 FNTA (0.73) SERPINA6LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL8755727 0.86 SERPINA6 (0.80) SERPINA6LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9221947 0.86 SERPINA6 (0.80) SERPINA6LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL10868078 0.86 SERPINA6 (0.80) SERPINA6LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL11794803 0.86 HIF1A (0.74) SERPINA6LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL8013392 0.86 HIF1A (0.74) SERPINA6LMNAMEN1KMT2ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0104054-A2 16-methylene-steroids and their preparation THE UPJOHN COMPANY (US) 1984-03-28 — — EP disclosed
US-4224320-A Novel steroids of the pregnane series, substituted in the 17-position, their manufacture and their use SCHERING, AKTIENGESELLSCHAFT (DE) 1980-09-23 — — US disclosed
US-4207316-A ANTIINFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 1980-06-10 — — US disclosed
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