SCHEMBL30911379

SCHEMBL30911379

CC(CO)c1nc(C(F)(F)F)cc2c(Br)n[nH]c12

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 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
SCHEMBL30911402 0.85 NT5E (0.33) NT5E
SCHEMBL30911374 0.79 CACNA1H (0.35) —
SCHEMBL30911387 0.77 NT5E (0.34) NT5E
SCHEMBL35211095 0.75 TRPA1 (0.35) —
SCHEMBL35210855 0.74 SOS1 (0.35) —
SCHEMBL35211335 0.74 SOS1 (0.35) —
SCHEMBL30911360 0.72 NT5E (0.33) NT5E
SCHEMBL30911367 0.69 CYP3A4 (0.31) —
SCHEMBL30911391 0.69 NT5E (0.34) NT5E
SCHEMBL35210853 0.63 NT5E (0.33) NT5E

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-2024074977-A1 SUBSTITUTED 1 H-PYRAZOLO-PYRIDINE AND-PYRIMIDINE COMPOUNDS PFIZER INC. (US) 2024-04-11 — — WO disclosed
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