SCHEMBL30833739

SCHEMBL30833739

CS(=O)(=O)C1C=CC(c2nc(Cl)ncc2Br)CC1

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 4/20 0.40
BCR P11274 4/20 0.40

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
SCHEMBL16566107 0.68 ABL1 (0.36) ABL1BCR
SCHEMBL28565709 0.66 KMT2A (0.38) ABL1BCR
SCHEMBL4579827 0.62 ABL1 (0.31) ABL1BCR
SCHEMBL7703222 0.61 ABL1 (0.34) ABL1BCR
Hydrochloric Acid SCHEMBL2596286 0.60 ABL1 (0.33) ABL1BCR
SCHEMBL6522308 0.60 KMT2A (0.43) ABL1BCR
SCHEMBL6522312 0.60 KMT2A (0.43) ABL1BCR
SCHEMBL27882094 0.60 KMT2A (0.43) ABL1BCR
SCHEMBL6522303 0.60 KMT2A (0.43) ABL1BCR
SCHEMBL22279296 0.59 KMT2A (0.33) ABL1BCR

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
CN-113896744-B Selective EGFR inhibitor 成都先导药物开发股份有限公司 2024-04-16 CN disclosed