SCHEMBL27315191

SCHEMBL27315191

COCc1ccc(NC(=O)c2c(-c3ccccc3)c(C(C)C)n3ncnc(N)c23)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 18/20 0.51
▸ NTRK1 P04629 2/20 0.49
▸ NTRK2 Q16620 2/20 0.49
▸ PLK4 O00444 1/20 0.49
▸ AURKA O14965 1/20 0.49
▸ DAPK3 O43293 1/20 0.49
▸ ROCK2 O75116 1/20 0.49
▸ PAK4 O96013 1/20 0.49
▸ CHEK2 O96017 1/20 0.49
▸ ABL1 P00519 1/20 0.49
▸ INSR P06213 1/20 0.49
▸ LCK P06239 1/20 0.49
▸ FYN P06241 1/20 0.49
▸ CSF1R P07333 1/20 0.49
▸ LYN P07948 1/20 0.49
▸ IGF1R P08069 1/20 0.49
▸ MET P08581 1/20 0.49
▸ KIT P10721 1/20 0.49
▸ PIM1 P11309 1/20 0.49
▸ FGFR1 P11362 1/20 0.49

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
SCHEMBL27315219 0.90 RET (0.54) RETNTRK1NTRK2PLK4AURKA
SCHEMBL27315613 0.86 RET (0.50) RET
SCHEMBL27315162 0.79 RET (0.56) RET
SCHEMBL27315615 0.79 NTRK1 (0.58) RETNTRK1NTRK2
SCHEMBL27314610 0.77 RET (0.47) RET
SCHEMBL27315152 0.77 RET (0.57) RET
SCHEMBL27394822 0.77 RET (0.57) RET
SCHEMBL27315622 0.76 NTRK1 (0.39) RETNTRK1NTRK2
SCHEMBL27315094 0.73 RET (0.46) RET
SCHEMBL27315234 0.69 RET (0.56) RET

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-4611900-A1 RET-LDD PROTEIN INHIBITORS Bristol-Myers Squibb Company (US) 2025-09-10 — — EP disclosed
WO-2024097980-A1 RET-LDD PROTEIN INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2024-05-10 — — WO disclosed
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