SCHEMBL10497312

SCHEMBL10497312

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

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 10/20 0.70
LMNA P02545 4/20 0.70
SMN1; SMN2 Q16637 5/20 0.61
SERPINA6 P08185 4/20 0.61
HSD17B10 Q99714 4/20 0.61
NR3C2 P08235 4/20 0.61
CYP3A4 P08684 4/20 0.61
NR3C1 P04150 3/20 0.61
CYP2C19 P33261 2/20 0.61
PGR P06401 2/20 0.61
SHBG P04278 2/20 0.61
MAPT P10636 2/20 0.61
NFKB1 P19838 2/20 0.61
KMT2A Q03164 1/20 0.61
HSD11B1 P28845 2/20 0.60
HSD11B2 P80365 2/20 0.60
AR P10275 1/20 0.59
CHRM1 P11229 1/20 0.59
CYP2C9 P11712 2/20 0.55
TSHR P16473 2/20 0.55

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
SCHEMBL10704078 1.00 HIF1A (0.70) HIF1ALMNASMN1; SMN2SERPINA6HSD17B10
SCHEMBL10497302 1.00 HIF1A (0.70) HIF1ALMNASMN1; SMN2SERPINA6HSD17B10
SCHEMBL11792996 1.00 HIF1A (0.70) HIF1ALMNASMN1; SMN2SERPINA6HSD17B10
SCHEMBL10062789 0.92 HIF1A (0.64) HIF1ALMNASMN1; SMN2SERPINA6HSD17B10
SCHEMBL147438 0.89 HIF1A (0.72) HIF1ALMNASMN1; SMN2SERPINA6HSD17B10
SCHEMBL10597610 0.89 HIF1A (0.72) HIF1ALMNASMN1; SMN2SERPINA6HSD17B10
SCHEMBL10597597 0.89 HIF1A (0.72) HIF1ALMNASMN1; SMN2SERPINA6HSD17B10
SCHEMBL10062395 0.89 HIF1A (0.72) HIF1ALMNASMN1; SMN2SERPINA6HSD17B10
SCHEMBL3649005 0.89 HIF1A (0.72) HIF1ALMNASMN1; SMN2SERPINA6HSD17B10
SCHEMBL8013397 0.87 HIF1A (0.74) HIF1ALMNASMN1; SMN2SERPINA6HSD17B10

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4839282-A Preparation of 3-oxo-Δ1,4 -steroids SCHERING AKTIENGESELLSCHAFT (DE) 1989-06-13 US disclosed
EP-0276393-A2 Process for the preparation of 6-alpha, 9-alpha-difluoro-11-beta-17-alpha-dihydroxy-16-alpha-methyl-pregn-4-ene-3,20-dione and its derivatives SCHERING AKTIENGESELLSCHAFT (DE) 1988-08-03 EP disclosed
EP-0054810-B1 PROCESS FOR THE PREPARATION OF 3-OXO-DELTA-1,4-STEROIDS SCHERING AKTIENGESELLSCHAFT (DE) 1986-07-30 EP disclosed
EP-0054810-A2 Process for the preparation of 3-oxo-delta-1,4-steroids SCHERING AKTIENGESELLSCHAFT (DE) 1982-06-30 EP disclosed
US-3956349-A TRIETHYL ORTHOACETATE, ACID CATALYST SYNTEX (U.S.A.) INC. (US) 1976-05-11 US disclosed