SCHEMBL11574275

SCHEMBL11574275

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

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 7/20 0.83
▸ NR3C1 P04150 7/20 0.83
▸ HIF1A Q16665 6/20 0.83
▸ LMNA P02545 3/20 0.83
▸ CYP3A4 P08684 2/20 0.83
▸ USP2 O75604 1/20 0.83
▸ CYP2D6 P10635 1/20 0.83
▸ CYP2C9 P11712 1/20 0.83
▸ ABCB11 O95342 2/20 0.61
▸ NR1I2 O75469 2/20 0.61
▸ ABCC3 O15438 1/20 0.61
▸ AR P10275 2/20 0.60
▸ CHRM1 P11229 1/20 0.60
▸ NR3C2 P08235 5/20 0.60
▸ HSD17B10 Q99714 2/20 0.57
▸ TNF P01375 1/20 0.57
▸ IL6 P05231 1/20 0.57
▸ SERPINA6 P08185 1/20 0.57
▸ GLUL P15104 1/20 0.57
▸ ADAM17 P78536 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
SCHEMBL11574271 1.00 PGR (0.83) PGRNR3C1HIF1ALMNACYP3A4
SCHEMBL11422082 0.95 NR3C1 (0.88) PGRNR3C1HIF1ALMNACYP3A4
SCHEMBL11015973 0.94 PGR (0.73) PGRNR3C1HIF1ALMNACYP3A4
SCHEMBL730945 0.93 HIF1A (0.79) PGRNR3C1HIF1ALMNACYP3A4
SCHEMBL2252725 0.92 NR3C1 (0.75) PGRNR3C1HIF1ALMNACYP3A4
SCHEMBL11431033 0.91 NR3C1 (0.88) PGRNR3C1HIF1ALMNACYP3A4
SCHEMBL11421286 0.91 PGR (0.88) PGRNR3C1HIF1ALMNACYP3A4
SCHEMBL20365864 0.91 PGR (0.88) PGRNR3C1HIF1ALMNACYP3A4
SCHEMBL11422219 0.91 PGR (0.78) PGRNR3C1HIF1ALMNACYP3A4
SCHEMBL11431806 0.91 NR3C1 (0.88) PGRNR3C1HIF1ALMNACYP3A4

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
JP-54130548-A — — None — — JP disclosed
JP-S54130548-A PREDNISOLONE DERIVATIVE TAISHO PHARMACEUT CO LTD 1979-10-09 — — JP disclosed
Send feedback