SCHEMBL13069748

SCHEMBL13069748

CC(=O)[C@@]1(O)CCC2C3C[C@H](C)C4=CC(=O)C=C[C@]4(C)C3[C@@H](O)C[C@@]21C

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 9/20 0.81
CYP3A4 P08684 7/20 0.81
PGR P06401 6/20 0.81
NR3C1 P04150 6/20 0.81
HSD17B10 Q99714 4/20 0.81
ALDH1A1 P00352 2/20 0.81
NR1I2 O75469 2/20 0.81
ABCB11 O95342 2/20 0.81
ABCC4 O15439 1/20 0.81
PDE4D Q08499 1/20 0.81
AR P10275 3/20 0.77
F2 P00734 1/20 0.77
CYP2C9 P11712 2/20 0.67
TSHR P16473 1/20 0.67
LMNA P02545 3/20 0.58
GAA P10253 1/20 0.58
HTT P42858 1/20 0.58
CYP2C19 P33261 2/20 0.55
TNF P01375 1/20 0.55
IL6 P05231 1/20 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
SCHEMBL11271565 1.00 HIF1A (0.81) HIF1ACYP3A4PGRNR3C1HSD17B10
SCHEMBL3397738 1.00 HIF1A (0.81) HIF1ACYP3A4PGRNR3C1HSD17B10
SCHEMBL3397741 1.00 HIF1A (0.81) HIF1ACYP3A4PGRNR3C1HSD17B10
SCHEMBL3406698 0.92 CYP3A4 (0.81) HIF1ACYP3A4PGRNR3C1HSD17B10
SCHEMBL3406702 0.92 CYP3A4 (0.81) HIF1ACYP3A4PGRNR3C1HSD17B10
SCHEMBL11691405 0.90 CYP3A4 (0.78) HIF1ACYP3A4PGRNR3C1HSD17B10
SCHEMBL11691394 0.90 CYP3A4 (0.78) HIF1ACYP3A4PGRNR3C1HSD17B10
SCHEMBL21145516 0.90 CYP3A4 (0.78) HIF1ACYP3A4PGRNR3C1HSD17B10
Methylprednisolone SCHEMBL541256 0.89 HIF1A (1.00) HIF1ACYP3A4PGRNR3C1HSD17B10
Methylprednisolone SCHEMBL21145528 0.89 HIF1A (1.00) HIF1ACYP3A4PGRNR3C1HSD17B10

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
EP-2246359-A1 Process for obtaining fluorometholone and intermediates therefor Crystal Pharma, S.L.U. (ES) 2010-11-03 EP disclosed
WO-2010122096-A1 PROCESS FOR OBTAINING FLUOROMETHOLONE AND INTERMEDIATES THEREFOR CRYSTAL PHARMA, S.L.U. (ES) 2010-10-28 WO disclosed