SCHEMBL27974634

SCHEMBL27974634

CN1CCN(Cc2cc(NC(=O)c3cccc(C#Cc4cnc5ccnn5c4)c3)cc(C(F)(F)F)c2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DDR1 Q08345 18/20 1.00
▸ DDR2 Q16832 16/20 1.00
▸ KIT P10721 9/20 1.00
▸ ABL1 P00519 8/20 0.81
▸ BCR P11274 3/20 0.81
▸ NTRK1 P04629 1/20 0.72
▸ NTRK3 Q16288 1/20 0.72
▸ NTRK2 Q16620 1/20 0.72

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
SCHEMBL3430553 0.90 DDR1 (1.00) DDR1DDR2KITABL1BCR
SCHEMBL30827014 0.89 DDR1 (1.00) DDR1DDR2KITABL1BCR
SCHEMBL27974623 0.89 DDR1 (1.00) DDR1DDR2KITABL1BCR
SCHEMBL19801991 0.89 DDR1 (1.00) DDR1DDR2KITABL1BCR
SCHEMBL27974636 0.84 DDR1 (1.00) DDR1DDR2KITABL1BCR
SCHEMBL27974402 0.83 DDR1 (1.00) DDR1DDR2KITABL1BCR
SCHEMBL27974624 0.83 DDR1 (1.00) DDR1DDR2KITABL1BCR
SCHEMBL22772380 0.81 DDR1 (0.67) DDR1DDR2KITABL1BCR
SCHEMBL24070159 0.81 DDR1 (0.72) DDR1DDR2KITABL1BCR
SCHEMBL27974416 0.80 DDR1 (1.00) DDR1DDR2KITABL1BCR

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-103965195-A Compound used for discoidin domain receptor micro-molecule inhibitor, and its application GUANGZHOU INST BIOMED & HEALTH 2014-08-06 — — CN disclosed
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