SCHEMBL30402918

SCHEMBL30402918

CN(CCOCCN1CCCCC1)C(=O)c1ccc(Nc2nccn3c(-c4ccc(OCC#N)c(F)c4F)cnc23)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 4/20 0.39
▸ LCK P06239 1/20 0.34
▸ EGFR P00533 5/20 0.34
▸ CSF1R P07333 2/20 0.33
▸ HTR2A P28223 6/20 0.33
▸ HTR2C P28335 6/20 0.33
▸ CCR2 P41597 1/20 0.32
▸ KDR P35968 1/20 0.32
▸ STK3 Q13188 1/20 0.32

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
SCHEMBL22124485 0.93 PTK6 (0.37) PTK6LCKEGFRCSF1RCCR2
SCHEMBL22124563 0.92 PTK6 (0.36) PTK6
SCHEMBL22123725 0.89 PTK6 (0.47) PTK6LCK
SCHEMBL30171867 0.89 PTK6 (0.47) PTK6LCK
SCHEMBL25176442 0.88 PTK6 (0.40) PTK6LCKEGFR
Iodide SCHEMBL28982230 0.88 PTK6 (0.39) PTK6LCKEGFR
SCHEMBL24112330 0.86 PTK6 (0.39) PTK6LCKEGFR
SCHEMBL28982185 0.86 PTK6 (0.39) PTK6LCKEGFR
SCHEMBL30171986 0.85 PTK6 (0.51) PTK6LCK
SCHEMBL24112346 0.84 PTK6 (0.39) PTK6LCKEGFRSTK3

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-3898630-B1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2023-05-10 — — EP claimed
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