SCHEMBL29945798

SCHEMBL29945798

C[C@@H](N)c1cc(F)cc(C#N)c1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.36
PGR P06401 2/20 0.35
MGLL Q99685 1/20 0.34
SOS1 Q07889 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
SCHEMBL23525972 1.00 GRM5 (0.36) GRM5PGRMGLLSOS1
SCHEMBL23525975 1.00 GRM5 (0.36) GRM5PGRMGLLSOS1
Hydrochloric Acid SCHEMBL31602980 0.98 GRM5 (0.36) GRM5PGRMGLLSOS1
Hydrochloric Acid SCHEMBL1006004 0.98 GRM5 (0.36) GRM5PGRMGLLSOS1
SCHEMBL23564081 0.84 GRM5 (0.35) GRM5PGR
SCHEMBL12262985 0.84 GRM5 (0.41) GRM5PGRSOS1
SCHEMBL27868545 0.81 GRM5 (0.36) GRM5PGRSOS1
SCHEMBL26463822 0.81 CYP11B1 (0.37) GRM5PGRMGLLSOS1
SCHEMBL16958513 0.81 GRM5 (0.36) GRM5PGRSOS1
SCHEMBL25632952 0.80 SOS1 (0.39) GRM5PGRSOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119546304-A Salts of SOS1 inhibitors 米拉蒂治疗公司 2025-02-28 CN disclosed
CN-119462626-A SOS1 inhibitors 米拉蒂治疗股份有限公司 2025-02-18 CN disclosed
CN-115135315-B SOS1 inhibitors 米拉蒂治疗股份有限公司 2024-11-26 CN disclosed
WO-2023240253-A2 MODULATORS OF TNF-ALPHA ACTIVITY FORWARD THERAPEUTICS, INC. (US) 2023-12-14 WO disclosed
CN-115135315-A SOS1 inhibitors 米拉蒂治疗股份有限公司 2022-09-30 CN disclosed