SCHEMBL30971205

SCHEMBL30971205

CCn1ccc2c(-c3c(C)ccc(OC)c3C)cc(C#N)nc21

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ USP2 O75604 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.33
▸ CTSS P25774 3/20 0.33
▸ CRHR1 P34998 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ MAPK1 P28482 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ DYRK1A Q13627 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ PRKCQ Q04759 1/20 0.31
▸ PRKCD Q05655 1/20 0.31
▸ EGFR P00533 1/20 0.30

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
SCHEMBL30971101 0.90 KDM4E (0.33) KDM4EHSD17B10MEN1KMT2AHPGD
SCHEMBL30971174 0.87 PRKCQ (0.36) KDM4EHSD17B10MEN1KMT2AHPGD
SCHEMBL30971313 0.85 ATP4A (0.38) MEN1KMT2AMAPTMAPK1TSHR
SCHEMBL30971335 0.80 GRM2 (0.38) ALDH1A1
SCHEMBL30971210 0.79 DYRK1A (0.36) KDM4EHSD17B10MEN1KMT2AHPGD
SCHEMBL30971116 0.78 PRMT5 (0.36) KDM4EMEN1KMT2AHPGDALDH1A1
SCHEMBL30971154 0.75 ATP4A (0.36) MEN1KMT2AMAPTMAPK1TSHR
SCHEMBL30971218 0.73 KDM4E (0.41) KDM4EHSD17B10MEN1KMT2AHPGD
SCHEMBL30971186 0.70 CTSS (0.33) KDM4EMEN1KMT2AALDH1A1CTSS
SCHEMBL30971261 0.70 DYRK1A (0.44) KDM4EHSD17B10MEN1KMT2AHPGD

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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