SCHEMBL31705188

SCHEMBL31705188

Cc1ccc2c(cnn2C2CCCCO2)c1NC(=O)c1cnc(NC(=O)c2ccccc2)s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 11/20 0.52
▸ MAPK14 Q16539 6/20 0.46
▸ MAPK13 O15264 1/20 0.46
▸ EGFR P00533 1/20 0.46
▸ FYN P06241 1/20 0.46
▸ HCK P08631 1/20 0.46
▸ SRC P12931 1/20 0.46
▸ JAK3 P52333 1/20 0.46
▸ MAPK12 P53778 1/20 0.46
▸ MAPK11 Q15759 1/20 0.46
▸ ABL1 P00519 1/20 0.42
▸ ACKR3 P25106 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TSHR P16473 1/20 0.38
▸ CCNE1 P24864 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ CDK5 Q00535 1/20 0.38

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
SCHEMBL31106051 0.88 MAPK14 (0.46) LCKMAPK14MAPK13EGFRFYN
SCHEMBL31105912 0.87 MAPK14 (0.50) LCKMAPK14MAPK13EGFRFYN
SCHEMBL31105893 0.86 LCK (0.41) LCKMAPK14MAPK13EGFRFYN
SCHEMBL31105951 0.85 LCK (0.43) LCKMAPK14MAPK13EGFRFYN
SCHEMBL31105942 0.85 LCK (0.42) LCKMAPK14MAPK13EGFRFYN
SCHEMBL31106019 0.84 LCK (0.45) LCKMAPK14MAPK13EGFRFYN
SCHEMBL31105865 0.84 LCK (0.46) LCKMAPK14MAPK13EGFRFYN
SCHEMBL31105905 0.83 MAPK14 (0.41) LCKMAPK14MAPK13EGFRFYN
SCHEMBL31105895 0.82 LCK (0.44) LCKMAPK14MAPK13EGFRFYN
SCHEMBL31105889 0.81 HCK (0.44) LCKMAPK14MAPK13EGFRFYN

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025215188-A1 THERAPEUTIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PKMYT1 MY-T BIO LIMITED (GB) 2025-10-16 — — WO disclosed
Send feedback