SCHEMBL29939692

SCHEMBL29939692

Cc1cn(-c2cc(NC(=O)c3ccc4c(c3)N(c3cncnc3)CC4)cc(C(F)(F)F)c2)cn1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DDR1 Q08345 9/20 0.68
▸ DDR2 Q16832 6/20 0.68
▸ NTRK3 Q16288 5/20 0.68
▸ NTRK1 P04629 4/20 0.68
▸ NTRK2 Q16620 4/20 0.68
▸ ABL1 P00519 10/20 0.66
▸ KIT P10721 2/20 0.66
▸ PDGFRB P09619 1/20 0.66
▸ BCR P11274 6/20 0.65
▸ MUSK O15146 1/20 0.65
▸ CDK11B P21127 1/20 0.65
▸ EPHA8 P29322 1/20 0.65
▸ CDK11A Q9UQ88 1/20 0.65
▸ NR2E1 Q9Y466 2/20 0.60
▸ SRC P12931 1/20 0.57
▸ LDLR P01130 1/20 0.55
▸ PCSK9 Q8NBP7 1/20 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
SCHEMBL27082313 1.00 DDR1 (0.68) DDR1DDR2NTRK3NTRK1NTRK2
SCHEMBL27082304 0.88 DDR1 (0.65) DDR1DDR2NTRK3NTRK1NTRK2
SCHEMBL29939696 0.88 DDR1 (0.65) DDR1DDR2NTRK3NTRK1NTRK2
SCHEMBL27081775 0.83 NR2E1 (0.59) DDR1DDR2NTRK3NTRK1NTRK2
SCHEMBL27081838 0.79 NR2E1 (0.67) DDR1DDR2NTRK3NTRK1NTRK2
SCHEMBL29940228 0.79 NR2E1 (0.67) DDR1DDR2NTRK3NTRK1NTRK2
SCHEMBL27083043 0.79 DDR1 (0.54) DDR1DDR2NTRK3NTRK1NTRK2
SCHEMBL27081687 0.79 DDR1 (0.54) DDR1DDR2NTRK3NTRK1NTRK2
SCHEMBL27081849 0.79 NR2E1 (0.57) DDR1DDR2NTRK3NTRK1NTRK2
SCHEMBL27081680 0.79 ABL1 (0.61) DDR1DDR2NTRK3NTRK1NTRK2

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
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