SCHEMBL24344355

SCHEMBL24344355

C/C=C(\C=C/C(C)CC)c1ccn2c(=O)c(C(C)C)cnc2c1O

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ KDM5A P29375 1/20 0.31

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
SCHEMBL24344030 0.74 — —
SCHEMBL24344032 0.74 KDM5A (0.32) KDM5A
SCHEMBL24344359 0.73 TTK (0.30) —
SCHEMBL19365017 0.71 KDM5A (0.37) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL17802271 0.71 BTK (0.34) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL17802285 0.70 KDM5A (0.36) KDM4EALDH1A1GAAHPGDKDM5A
SCHEMBL10027232 0.70 KDM5A (0.36) KDM4EALDH1A1GAAHPGDKDM5A
SCHEMBL24344625 0.69 KDM5A (0.30) KDM5A
SCHEMBL19361128 0.68 KDM6B (0.33) ALDH1A1KDM5A
SCHEMBL21577470 0.68 — —

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
EP-3227292-B1 4H-PYRIDO[1,2-a]PYRIMIDIN-4-ONE COMPOUNDS ALTERITY THERAPEUTICS LTD (AU) 2022-03-09 — — EP disclosed
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