SCHEMBL23536726

SCHEMBL23536726

CCOC=Cc1cc(N)cc(C(F)(F)F)c1F

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GLA P06280 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 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
SCHEMBL23536622 0.77 IDO1 (0.33) —
SCHEMBL25923518 0.71 GLA (0.39) GLAPOLBGAATSHR
SCHEMBL16727137 0.71 RPS6KB1 (0.31) —
SCHEMBL27318016 0.69 GLA (0.35) GLAPOLBGAATSHRALDH1A1
SCHEMBL31477237 0.69 PTP4A3 (0.39) GAATSHR
SCHEMBL16454234 0.69 KDM4E (0.36) GLATSHRALDH1A1
SCHEMBL21598907 0.67 NPSR1 (0.32) GLAALDH1A1
SCHEMBL17808200 0.66 HPGD (0.33) GLAGAAALDH1A1
SCHEMBL31089280 0.66 MAPT (0.40) POLBGAAMAPT
SCHEMBL24885610 0.65 GLA (0.41) GLAPOLBGAATSHRALDH1A1

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
EP-4076418-A1 SOS1 INHIBITORS Mirati Therapeutics, Inc. (US) 2022-10-26 — — EP disclosed
WO-2021127429-A1 SOS1 INHIBITORS Mirati Therapeutics, Inc. (US) 2021-06-24 — — WO disclosed
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