SCHEMBL30979084

SCHEMBL30979084

CNc1nc2nncn2c2cc(N)ccc12

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.37
▸ MAT2A P31153 3/20 0.34
▸ MAPT P10636 1/20 0.34
▸ TP53 P04637 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL30978994 0.83 TOP2A (0.40) TOP2AKDM4EMAT2AMAPTALDH1A1
SCHEMBL23601428 0.83 MAT2A (0.48) MAT2AMAPT
SCHEMBL30961075 0.82 SMN1; SMN2 (0.48) KDM4EMAPTTP53RXFP1KMT2A
SCHEMBL30979110 0.81 TOP2A (0.39) TOP2AKDM4EMAT2AMAPTTP53
SCHEMBL30979090 0.80 KDM4E (0.39) KDM4EMAPTKMT2AALDH1A1
SCHEMBL30979101 0.80 TOP2A (0.37) TOP2AKDM4EMAT2AMAPTALDH1A1
SCHEMBL29909120 0.79 TOP2A (0.54) TOP2AKDM4EMAPTTP53RXFP1
SCHEMBL30979136 0.78 KDM4E (0.36) TOP2AKDM4EMAPTTP53
SCHEMBL30979012 0.78 HRH4 (0.43) TOP2AKDM4EMAPTALDH1A1
SCHEMBL30920847 0.77 KDM4E (0.39) TOP2AKDM4EMAPTTP53KMT2A

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
CN-118324767-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-07-12 — — CN disclosed
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