SCHEMBL30048544

SCHEMBL30048544

Nc1nc2nncn2c2ccc(F)cc12

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.37
▸ ADORA2A P29274 2/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ PDK1 Q15118 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
SCHEMBL30961037 0.78 SMN1; SMN2 (0.42) MAPTSMN1; SMN2KDM4E
SCHEMBL29909498 0.77 SMN1; SMN2 (0.46) MAPTSMN1; SMN2KDM4E
SCHEMBL31229473 0.75 SMN1; SMN2 (0.43) MAPTSMN1; SMN2
SCHEMBL30979090 0.74 KDM4E (0.39) MAPTSMN1; SMN2KDM4E
SCHEMBL30013412 0.73 CYP11B2 (0.38) MAPTSMN1; SMN2KDM4E
SCHEMBL30013879 0.72 STAT3 (0.53) MAPTSMN1; SMN2KDM4E
SCHEMBL23578049 0.72 ABCG2 (0.42) SMN1; SMN2
SCHEMBL30978941 0.72 MAT2A (0.48) MAPTSMN1; SMN2KDM4E
SCHEMBL30920881 0.71 TNKS2 (0.37) MAPTSMN1; SMN2ADORA2AADORA1
SCHEMBL10846882 0.71 HCRTR1 (0.46) KDM4EADORA2AADORA1

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-4359415-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2024-05-01 — — EP disclosed
WO-2022271684-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2022-12-29 — — WO disclosed
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