SCHEMBL29940085

SCHEMBL29940085

CN1CCN(Cc2ccc(NC(=O)c3ccc4c(c3)N(Cc3cncc(C#N)c3)CC4)cc2C(F)(F)F)CC1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 3/20 0.58
▸ KIT P10721 4/20 0.58
▸ RET P07949 2/20 0.57
▸ FGFR1 P11362 9/20 0.57
▸ KDR P35968 9/20 0.57
▸ BRAF P15056 3/20 0.55
▸ EGFR P00533 2/20 0.55

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
SCHEMBL27082274 1.00 ABL1 (0.58) ABL1KITRETFGFR1KDR
SCHEMBL27082321 0.88 BRAF (0.59) ABL1KITRETFGFR1KDR
SCHEMBL29940076 0.88 BRAF (0.59) ABL1KITRETFGFR1KDR
SCHEMBL27083161 0.84 BRAF (0.68) ABL1KITRETBRAFEGFR
SCHEMBL27083160 0.84 BRAF (0.68) ABL1KITBRAFEGFR
SCHEMBL27081580 0.84 BRAF (0.55) ABL1KITRETBRAFEGFR
SCHEMBL29967823 0.84 BRAF (0.55) ABL1KITRETBRAFEGFR
SCHEMBL27083097 0.83 EGFR (0.68) ABL1FGFR1BRAFEGFR
SCHEMBL27082299 0.83 BRAF (0.59) ABL1KITBRAFEGFR
SCHEMBL27082370 0.83 KIT (0.63) ABL1KITRETBRAFEGFR

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-4313292-A1 INDOLINE DERIVATIVES AS DDR1 AND DDR2 INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2024-02-07 — — EP disclosed
WO-2022200576-A1 INDOLINE DERIVATIVES AS DDR1 AND DDR2 INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2022-09-29 — — WO disclosed
Send feedback