SCHEMBL29265018

SCHEMBL29265018

O=C1Nc2ccc(NCc3cc(F)cc(F)c3)cc2/C1=C/c1cncs1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 20/20 1.00
▸ NTRK3 Q16288 3/20 0.68

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
SCHEMBL29265022 1.00 NTRK1 (1.00) NTRK1NTRK3
SCHEMBL30997322 1.00 NTRK1 (1.00) NTRK1NTRK3
SCHEMBL29264961 0.84 NTRK1 (1.00) NTRK1NTRK3
SCHEMBL30997331 0.84 NTRK1 (1.00) NTRK1NTRK3
SCHEMBL29264959 0.84 NTRK1 (1.00) NTRK1NTRK3
SCHEMBL29264971 0.81 NTRK1 (1.00) NTRK1NTRK3
SCHEMBL29264975 0.81 NTRK1 (1.00) NTRK1NTRK3
SCHEMBL29264956 0.79 NTRK1 (1.00) NTRK1NTRK3
SCHEMBL29264958 0.79 NTRK1 (1.00) NTRK1NTRK3
SCHEMBL29265016 0.77 NTRK1 (1.00) NTRK1NTRK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118221652-A Indol-2-one derivative and preparation method and application thereof 沈阳药科大学 2024-06-21 — — CN claimed
CN-118221652-A Indol-2-one derivative and preparation method and application thereof 沈阳药科大学 2024-06-21 — — CN disclosed
Send feedback