SCHEMBL25924821

SCHEMBL25924821

CCC(CC)n1ncc2cccc(C(F)(F)F)c21

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 2/20 0.35
▸ P2RX7 Q99572 1/20 0.35
▸ TRPA1 O75762 2/20 0.35
▸ HSD11B1 P28845 7/20 0.33
▸ CCR1 P32246 1/20 0.32
▸ ACHE P22303 1/20 0.32
▸ MDM2 Q00987 3/20 0.32
▸ NR3C1 P04150 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ PARP1 P09874 1/20 0.31

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
SCHEMBL25923933 0.73 HCAR3 (0.38) ESR1P2RX7HSD11B1
SCHEMBL25922298 0.69 PRPS1 (0.41) ESR1P2RX7HSD11B1POLB
SCHEMBL13115635 0.67 KMO (0.43) ESR1MDM2POLB
SCHEMBL21725659 0.66 HTR2A (0.42) ESR1P2RX7POLBMAPK1
Piperidine SCHEMBL2959417 0.65 TRPA1 (0.40) P2RX7TRPA1MDM2
SCHEMBL23717737 0.65 CYP19A1 (0.40) MDM2
SCHEMBL23717652 0.62 P2RX7 (0.42) P2RX7POLB
SCHEMBL31698874 0.61 CYP1A2 (0.37) ESR1TRPA1
SCHEMBL21725617 0.60 HSD11B1 (0.39) HSD11B1MDM2
SCHEMBL21725615 0.60 ESR1 (0.39) ESR1P2RX7HSD11B1MDM2

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
WO-2023141432-A2 APOL1 INHIBITORS AND METHODS OF USE MAZE THERAPEUTICS, INC. (US) 2023-07-27 — — WO disclosed
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