SCHEMBL22065350

SCHEMBL22065350

Cc1nc(-c2cccnc2)cc(Nc2cccc(C(=O)Nc3cc(CN4CCN(C)CC4)cc(C(F)(F)F)c3)c2)ccc[nH]1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DDR2 Q16832 12/20 0.57
▸ DDR1 Q08345 12/20 0.57
▸ ABL1 P00519 8/20 0.56
▸ BCR P11274 6/20 0.56
▸ KIT P10721 4/20 0.53
▸ NTRK1 P04629 2/20 0.53
▸ NTRK3 Q16288 2/20 0.53
▸ NTRK2 Q16620 2/20 0.53
▸ PDGFRB P09619 1/20 0.52
▸ SRC P12931 1/20 0.52
▸ PDGFRA P16234 1/20 0.52
▸ SYK P43405 1/20 0.52
▸ CSF1R P07333 2/20 0.50
▸ RET P07949 1/20 0.50

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
SCHEMBL22024549 0.87 PIKFYVE (0.59) DDR2DDR1ABL1BCRKIT
SCHEMBL22024550 0.81 PIKFYVE (0.65) DDR2DDR1ABL1BCRKIT
SCHEMBL13219960 0.80 DDR2 (0.72) DDR2DDR1ABL1BCRKIT
SCHEMBL22024709 0.80 DDR2 (0.52) DDR2DDR1ABL1BCRKIT
SCHEMBL21943727 0.77 DDR2 (0.53) DDR2DDR1ABL1BCRKIT
SCHEMBL21943487 0.77 DDR2 (0.54) DDR2DDR1ABL1BCRKIT
SCHEMBL22065199 0.77 DDR1 (0.63) DDR2DDR1ABL1BCRKIT
SCHEMBL21943400 0.75 RET (0.60) DDR2DDR1ABL1BCRKIT
SCHEMBL22024670 0.74 DDR1 (0.61) DDR2DDR1ABL1BCRKIT
SCHEMBL29864626 0.74 DDR2 (0.71) DDR2DDR1ABL1BCRKIT

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
EP-3663293-A1 SUBSTITUTED PENTA- AND HEXA-HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, DRUG COMBINATION AND USE THEREOF Xiamen University (CN) 2020-06-10 — — EP disclosed
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