SCHEMBL30971218

SCHEMBL30971218

COc1ccc(C)c(-c2cc(C#N)nc(C)c2N)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 12/20 0.41
▸ ALDH1A1 P00352 7/20 0.41
▸ HPGD P15428 4/20 0.41
▸ USP2 O75604 4/20 0.38
▸ HSD17B10 Q99714 4/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ GLA P06280 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ GFER P55789 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ ADORA2A P29274 2/20 0.34
▸ ADORA1 P30542 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ RCE1 Q9Y256 1/20 0.34

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
SCHEMBL30971174 0.77 PRKCQ (0.36) KDM4EALDH1A1HPGDUSP2HSD17B10
SCHEMBL30971088 0.76 ADORA3 (0.41) KDM4EALDH1A1HPGDUSP2HSD17B10
SCHEMBL30971210 0.76 DYRK1A (0.36) KDM4EALDH1A1HPGDUSP2HSD17B10
SCHEMBL30971116 0.75 PRMT5 (0.36) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL30971052 0.75 TUBB4A (0.36) KDM4EALDH1A1HPGDUSP2HSD17B10
SCHEMBL31303763 0.74 KDM4E (0.43) KDM4EALDH1A1HPGDUSP2HSD17B10
SCHEMBL30971205 0.73 KDM4E (0.35) KDM4EALDH1A1HPGDUSP2HSD17B10
SCHEMBL31303757 0.72 PKMYT1 (0.45) KDM4EALDH1A1HPGDUSP2HSD17B10
SCHEMBL30905538 0.70 KDM4E (0.40) KDM4EALDH1A1HPGDUSP2HSD17B10
SCHEMBL27403358 0.70 KDM4E (0.40) KDM4EALDH1A1HPGDUSP2HSD17B10

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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