SCHEMBL10355892

SCHEMBL10355892

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 10/20 0.56
▸ CYP3A4 P08684 7/20 0.56
▸ HSD17B10 Q99714 4/20 0.56
▸ CYP2C9 P11712 2/20 0.56
▸ ALDH1A1 P00352 2/20 0.56
▸ TSHR P16473 1/20 0.56
▸ KMT2A Q03164 3/20 0.54
▸ NR3C1 P04150 6/20 0.52
▸ PGR P06401 5/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ LMNA P02545 1/20 0.52
▸ ABCB11 O95342 2/20 0.51
▸ AR P10275 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ NR3C2 P08235 4/20 0.46
▸ CYP2C19 P33261 2/20 0.45
▸ SHBG P04278 1/20 0.45
▸ SERPINA6 P08185 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ NFKB1 P19838 1/20 0.45

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
SCHEMBL10355891 1.00 HIF1A (0.56) HIF1ACYP3A4HSD17B10CYP2C9ALDH1A1
SCHEMBL10427817 0.92 HIF1A (0.56) HIF1ACYP3A4HSD17B10CYP2C9ALDH1A1
SCHEMBL10427768 0.92 HIF1A (0.56) HIF1ACYP3A4HSD17B10CYP2C9ALDH1A1
SCHEMBL10427784 0.89 NR3C2 (0.55) HIF1ACYP3A4HSD17B10CYP2C9ALDH1A1
SCHEMBL10427783 0.89 NR3C2 (0.55) HIF1ACYP3A4HSD17B10CYP2C9ALDH1A1
SCHEMBL10892119 0.89 HIF1A (0.55) HIF1ACYP3A4HSD17B10CYP2C9ALDH1A1
SCHEMBL10892103 0.89 HIF1A (0.55) HIF1ACYP3A4HSD17B10CYP2C9ALDH1A1
SCHEMBL10427881 0.89 HIF1A (0.59) HIF1ACYP3A4HSD17B10CYP2C9ALDH1A1
SCHEMBL10427796 0.89 HIF1A (0.59) HIF1ACYP3A4HSD17B10CYP2C9ALDH1A1
SCHEMBL10891061 0.84 HIF1A (0.64) HIF1ACYP3A4HSD17B10CYP2C9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0149222-B1 6-ALPHA, 16 ALPHA-DIMETHYL CORTICOIDS SCHERING AKTIENGESELLSCHAFT (DE) 1990-11-07 — — EP disclosed
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