SCHEMBL30971158

SCHEMBL30971158

COc1ccc(C)c(-c2cc(C(N)=O)nc3c2cc(C)n3C)c1C

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 13/20 0.39
▸ PKMYT1 Q99640 1/20 0.39
▸ CYP19A1 P11511 1/20 0.34
▸ NQO2 P16083 1/20 0.34
▸ PIM1 P11309 1/20 0.34
▸ PIM3 Q86V86 1/20 0.34
▸ PIM2 Q9P1W9 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.33
▸ SYK P43405 1/20 0.33

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
SCHEMBL30971070 0.86 GRM2 (0.39) GRM2PKMYT1HSD17B10SYK
SCHEMBL30971089 0.84 GRM2 (0.39) GRM2PKMYT1
SCHEMBL30971335 0.81 GRM2 (0.38) GRM2PKMYT1SYK
SCHEMBL30971221 0.81 PKMYT1 (0.36) GRM2PKMYT1NQO2PIM1PIM3
SCHEMBL30971210 0.80 DYRK1A (0.36) CYP19A1NQO2HSD17B10
SCHEMBL27401560 0.79 GRM2 (0.58) GRM2
SCHEMBL30971254 0.78 PKMYT1 (0.36) GRM2PKMYT1NQO2PIM1PIM3
SCHEMBL30971267 0.78 NQO2 (0.41) GRM2PKMYT1NQO2PIM1PIM3
SCHEMBL30971160 0.78 DYRK1A (0.41) GRM2PKMYT1PIM1PIM3PIM2
SCHEMBL30971213 0.77 GRM2 (0.38) GRM2PKMYT1

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-4638420-A1 COMPOUNDS THAT INHIBIT PKMYT1 Exelixis, Inc. (US) 2025-10-29 — — EP disclosed
WO-2024137671-A1 COMPOUNDS THAT INHIBIT PKMYT1 EXELIXIS, INC. (US) 2024-06-27 — — WO disclosed
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