SCHEMBL24965982

SCHEMBL24965982

COC(=O)C(C)(C)Nc1ccc(C(=O)O)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
RARB P10826 5/20 0.41
RARA P10276 4/20 0.41
RARG P13631 2/20 0.41
ABCC9 O60706 1/20 0.40
ABCC8 Q09428 1/20 0.40
KCNJ11 Q14654 1/20 0.40
KCNJ8 Q15842 1/20 0.40
AKR1C3 P42330 6/20 0.39
AKR1C2 P52895 6/20 0.39
FABP4 P15090 1/20 0.36
RORC P51449 1/20 0.36
CTSV O60911 1/20 0.36
CTSL P07711 1/20 0.36
SLC22A12 Q96S37 1/20 0.35
PTGFR P43088 1/20 0.35

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
SCHEMBL17658331 0.88 KDM4E (0.40) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL10020940 0.88 MAOB (0.39) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL29563554 0.88 KDM4E (0.40) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL190082 0.87 DGAT1 (0.44) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL2407352 0.86 EPHX2 (0.44) EPHX2NR1H4RARBRARARARG
SCHEMBL2411518 0.86 GAA (0.44) EPHX2NR1H4ABCC9ABCC8KCNJ11
SCHEMBL29644326 0.86 GAA (0.44) EPHX2NR1H4ABCC9ABCC8KCNJ11
SCHEMBL582706 0.85 POLB (0.44) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL12321278 0.83 NPC1 (0.39) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL753288 0.83 EPHX2 (0.46) EPHX2NR1H4RARBRARARARG

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-3527556-B1 METHOD FOR PREPARING DEUTERATED IMIDAZOLE DIKETONE COMPOUND HINOVA PHARMACEUTICALS INC (CN) 2023-01-25 EP disclosed