SCHEMBL24347464

SCHEMBL24347464

CC(Nc1ccn2ncc(C(=O)O)c2n1)c1cc(F)cc2c1OC(CN)C2

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 20/20 0.45
▸ NTRK3 Q16288 9/20 0.45
▸ NTRK2 Q16620 9/20 0.45

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
SCHEMBL22695100 1.00 NTRK1 (0.45) NTRK1NTRK3NTRK2
SCHEMBL22688739 0.94 NTRK1 (0.46) NTRK1NTRK3NTRK2
SCHEMBL22688740 0.94 NTRK1 (0.46) NTRK1NTRK3NTRK2
SCHEMBL22688882 0.91 NTRK1 (0.42) NTRK1NTRK3NTRK2
SCHEMBL22688879 0.91 NTRK1 (0.42) NTRK1NTRK3NTRK2
SCHEMBL24347465 0.88 NTRK1 (0.47) NTRK1NTRK3NTRK2
SCHEMBL24347036 0.88 NTRK1 (0.45) NTRK1NTRK3NTRK2
SCHEMBL22688746 0.88 NTRK1 (0.45) NTRK1NTRK3NTRK2
SCHEMBL22688743 0.88 NTRK1 (0.45) NTRK1NTRK3NTRK2
SCHEMBL29422670 0.88 NTRK1 (0.45) NTRK1NTRK3NTRK2

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
EP-3974434-A1 MACROLIDE DERIVATIVES, PREPARATION METHOD AND APPLICATION THEREOF Zhejiang Hisun Pharmaceutical Co., Ltd. (CN) 2022-03-30 — — EP disclosed
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