SCHEMBL30536636

SCHEMBL30536636

Oc1ccc(OCF)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
ESR1 P03372 6/20 0.38
ESR2 Q92731 4/20 0.38
TYR P14679 1/20 0.35
MRGPRX4 Q96LA9 2/20 0.35
MIF P14174 1/20 0.34

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
SCHEMBL19954040 0.85 KIF11 (0.47) ESR1ESR2
SCHEMBL11243691 0.83 L3MBTL1 (0.43) LMNAESR1ESR2MRGPRX4
SCHEMBL25797851 0.82 THRA (0.43) LMNA
SCHEMBL25797919 0.82 THRA (0.43) LMNA
SCHEMBL11234657 0.82 THRA (0.43) LMNA
SCHEMBL1510012 0.82 KDM1A (0.50) LMNA
SCHEMBL25798014 0.80 APP (0.40) LMNAESR1ESR2
SCHEMBL7763431 0.79 APP (0.49) LMNA
SCHEMBL31464131 0.79 BACE1 (0.43) LMNAESR1ESR2MRGPRX4
SCHEMBL27140275 0.79 BACE1 (0.43) LMNAESR1ESR2MRGPRX4

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
CN-116600801-A HSD17B13 inhibitors and uses thereof FL2022-001公司 2023-08-15 CN disclosed