SCHEMBL9627202

SCHEMBL9627202

CC(=O)[C@@]1(O)[C@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 8/20 0.59
▸ CYP3A4 P08684 4/20 0.59
▸ CYP2C9 P11712 2/20 0.59
▸ HSD17B10 Q99714 2/20 0.59
▸ TSHR P16473 1/20 0.59
▸ ALDH1A1 P00352 1/20 0.59
▸ NR3C1 P04150 5/20 0.58
▸ PGR P06401 3/20 0.58
▸ AR P10275 3/20 0.58
▸ ABCB11 O95342 2/20 0.58
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ NPSR1 Q6W5P4 1/20 0.58
▸ LMNA P02545 3/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ CYP19A1 P11511 2/20 0.45
▸ SERPINA6 P08185 1/20 0.44
▸ CYP2C19 P33261 3/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ MAPT P10636 1/20 0.43

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
SCHEMBL9627206 1.00 HIF1A (0.59) HIF1ACYP3A4CYP2C9HSD17B10TSHR
SCHEMBL11432685 0.92 HIF1A (0.58) HIF1ACYP3A4CYP2C9HSD17B10TSHR
SCHEMBL11432675 0.92 HIF1A (0.58) HIF1ACYP3A4CYP2C9HSD17B10TSHR
SCHEMBL11807661 0.91 HIF1A (0.56) HIF1ACYP3A4CYP2C9HSD17B10TSHR
SCHEMBL11807654 0.91 HIF1A (0.56) HIF1ACYP3A4CYP2C9HSD17B10TSHR
SCHEMBL11311611 0.90 PGR (0.68) HIF1ACYP3A4CYP2C9HSD17B10TSHR
SCHEMBL11311598 0.90 PGR (0.68) HIF1ACYP3A4CYP2C9HSD17B10TSHR
SCHEMBL11313619 0.90 PGR (0.68) HIF1ACYP3A4CYP2C9HSD17B10TSHR
SCHEMBL11417094 0.88 ABCB11 (0.70) HIF1ACYP3A4CYP2C9HSD17B10TSHR
SCHEMBL11417086 0.88 ABCB11 (0.70) HIF1ACYP3A4CYP2C9HSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0276393-B1 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) 1992-03-04 — — EP claimed
US-4898693-A Process for production of 6α,9α-difluoro-11β,17α-dihydroxy-16α-methyl-4-pregnene-3,20-dione and its derivatives SCHERING AKTIENGESELLSCHAFT (DE) 1990-02-06 — — US claimed
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 claimed
EP-0276393-B1 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) 1992-03-04 — — EP disclosed
US-4898693-A Process for production of 6α,9α-difluoro-11β,17α-dihydroxy-16α-methyl-4-pregnene-3,20-dione and its derivatives SCHERING AKTIENGESELLSCHAFT (DE) 1990-02-06 — — 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
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