SCHEMBL29935974

SCHEMBL29935974

Cc1c(I)cnc(N)c1F

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 2/20 0.35
NOS2 P35228 2/20 0.35
NOS1 P29475 1/20 0.35
USP7 Q93009 1/20 0.30

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
SCHEMBL26697653 1.00 NOS3 (0.35) NOS3NOS2NOS1USP7
SCHEMBL14047184 0.77 NOS3 (0.38) NOS3NOS2NOS1USP7
SCHEMBL2222027 0.77 NOS3 (0.38) NOS3NOS2NOS1USP7
SCHEMBL2220883 0.74 PLAU (0.39) NOS3NOS2NOS1USP7
SCHEMBL9938335 0.74
SCHEMBL25194457 0.74 HTT (0.40) NOS3NOS2NOS1USP7
SCHEMBL30457008 0.74 HTT (0.40) NOS3NOS2NOS1USP7
SCHEMBL29935853 0.74
SCHEMBL20822293 0.72 NOS3 (0.46) NOS3NOS2NOS1USP7
SCHEMBL29936876 0.71 HPGD (0.34) NOS3NOS2NOS1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4323356-A1 AMINO-SUBSTITUTED HETEROCYCLES FOR TREATING CANCERS WITH EGFR MUTATIONS Nuvalent, Inc. (US) 2024-02-21 EP disclosed
WO-2022221227-A9 AMINO-SUBSTITUTED HETEROCYCLES FOR TREATING CANCERS WITH EGFR MUTATIONS NUVALENT, INC. (US) 2023-11-30 WO disclosed
WO-2022221227-A1 AMINO-SUBSTITUTED HETEROCYCLES FOR TREATING CANCERS WITH EGFR MUTATIONS NUVALENT, INC. (US) 2022-10-20 WO disclosed