SCHEMBL30979110

SCHEMBL30979110

CC#Cc1ccc2c(NC)nc3nncn3c2c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 1/20 0.39
▸ CYP1A1 P04798 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP1B1 Q16678 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.34
▸ MAPT P10636 1/20 0.32
▸ TP53 P04637 1/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ MAT2A P31153 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ PARP15 Q460N3 1/20 0.30
▸ PARP10 Q53GL7 1/20 0.30
▸ TNKS2 Q9H2K2 1/20 0.30
▸ PARP2 Q9UGN5 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
SCHEMBL30978935 0.83 CYP1A1 (0.41) CYP1A1CYP1A2CYP1B1KDM4EMAPT
SCHEMBL30979084 0.81 TOP2A (0.43) TOP2AKDM4EMAPTTP53RXFP1
SCHEMBL30978994 0.79 TOP2A (0.40) TOP2AKDM4EMAPTMAT2AALDH1A1
SCHEMBL23601428 0.79 MAT2A (0.48) MAPTMAT2A
SCHEMBL30979101 0.75 TOP2A (0.37) TOP2AKDM4EMAPTMAT2AALDH1A1
SCHEMBL29909120 0.75 TOP2A (0.54) TOP2AKDM4EMAPTTP53RXFP1
SCHEMBL29909000 0.74 CYP1A1 (0.39) CYP1A1CYP1A2CYP1B1MAPT
SCHEMBL23577064 0.74 CYP1A1 (0.39) CYP1A1CYP1A2CYP1B1MAPT
SCHEMBL30979012 0.73 HRH4 (0.43) TOP2ACYP1A2KDM4EMAPTALDH1A1
SCHEMBL30920847 0.72 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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