SCHEMBL28971900

SCHEMBL28971900

CC(C)c1ccc(C(=O)Nc2cc(CN3CCN(C)CC3)cc(C(F)(F)F)c2)cc1Cn1cccc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DDR1 Q08345 19/20 0.63
▸ DDR2 Q16832 19/20 0.63
▸ ABL1 P00519 14/20 0.63
▸ NTRK1 P04629 2/20 0.59
▸ NTRK3 Q16288 2/20 0.59
▸ NTRK2 Q16620 2/20 0.59
▸ STK10 O94804 1/20 0.59
▸ LCK P06239 1/20 0.59
▸ EPHA2 P29317 1/20 0.59
▸ EPHA8 P29322 1/20 0.59
▸ EPHB2 P29323 1/20 0.59
▸ TEK Q02763 1/20 0.59
▸ EPHA7 Q15375 1/20 0.59
▸ BCR P11274 2/20 0.54
▸ KIT P10721 1/20 0.54

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
SCHEMBL28971866 0.89 ABL1 (0.62) DDR1DDR2ABL1NTRK1NTRK3
SCHEMBL25339278 0.89 DDR2 (0.60) DDR1DDR2ABL1NTRK1NTRK3
SCHEMBL30211944 0.89 DDR2 (0.60) DDR1DDR2ABL1NTRK1NTRK3
SCHEMBL30211926 0.83 DDR1 (0.63) DDR1DDR2ABL1NTRK1NTRK3
SCHEMBL24070210 0.83 DDR1 (0.63) DDR1DDR2ABL1NTRK1NTRK3
SCHEMBL30211959 0.83 DDR1 (0.67) DDR1DDR2ABL1NTRK1NTRK3
SCHEMBL25338578 0.83 DDR1 (0.67) DDR1DDR2ABL1NTRK1NTRK3
SCHEMBL30211967 0.83 DDR1 (0.67) DDR1DDR2ABL1NTRK1NTRK3
SCHEMBL25337608 0.81 DDR1 (0.57) DDR1DDR2ABL1NTRK1NTRK3
SCHEMBL29864626 0.80 DDR2 (0.71) DDR1DDR2ABL1NTRK1NTRK3

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
CN-115697485-A Benzylamine derivatives as DDR inhibitors 奇斯药制品公司 2023-02-03 — — CN claimed
CN-115697485-A Benzylamine derivatives as DDR inhibitors 奇斯药制品公司 2023-02-03 — — CN disclosed
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