SCHEMBL25639522

SCHEMBL25639522

Cc1ncc(C(=O)Nc2ccc(OC(F)(F)Cl)cc2)cc1-c1ccn[nH]1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 20/20 0.71
▸ BCR P11274 1/20 0.67
▸ KCNH2 Q12809 1/20 0.67
▸ CRBN Q96SW2 1/20 0.67

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
SCHEMBL19544754 0.89 ABL1 (0.73) ABL1
SCHEMBL15393069 0.89 ABL1 (0.87) ABL1BCRKCNH2CRBN
SCHEMBL25641409 0.89 ABL1 (0.69) ABL1
SCHEMBL19544765 0.87 ABL1 (0.65) ABL1
SCHEMBL17909940 0.86 ABL1 (0.91) ABL1
SCHEMBL19544760 0.85 ABL1 (0.68) ABL1
SCHEMBL19544730 0.85 ABL1 (0.71) ABL1
SCHEMBL19545243 0.84 ABL1 (0.87) ABL1BCRKCNH2CRBN
SCHEMBL19544739 0.83 ABL1 (0.65) ABL1BCRKCNH2CRBN
SCHEMBL20149006 0.83 ABL1 (0.88) ABL1

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
WO-2023114759-A2 ABL INHIBITORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-22 — — WO disclosed
WO-2023104155-A1 LIGAND COMPOUNDS FOR E3 UBIQUITIN LIGASE, PROTEIN DEGRADERS DEVELOPED ON BASIS OF LIGAND COMPOUNDS, AND USES THEREOF 标新生物医药科技(上海)有限公司 2023-06-15 — — WO disclosed
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