SCHEMBL30979121

SCHEMBL30979121

Cc1nnc2nc(Nc3ccccc3)c3ccc(S(C)(=O)=O)cc3n12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 5/20 0.46
▸ MAPT P10636 5/20 0.40
▸ HPGD P15428 4/20 0.40
▸ KDM4E B2RXH2 4/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ RECQL P46063 1/20 0.40
▸ KMT2A Q03164 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ GSK3B P49841 1/20 0.37
▸ PIP4K2A P48426 1/20 0.37
▸ PIP4K2C Q8TBX8 1/20 0.37
▸ TP53 P04637 4/20 0.37
▸ LMNA P02545 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36

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
SCHEMBL30979076 0.82 EGFR (0.42) MAPTKDM4EALDH1A1KMT2AGAA
SCHEMBL30978962 0.81 ALDH1A1 (0.34) KDM1AMAPTHPGDKDM4EALDH1A1
SCHEMBL30979115 0.81 KDM4E (0.46) KDM1AMAPTKDM4EALDH1A1KMT2A
SCHEMBL30979097 0.81 ABCG2 (0.49) MAPTHPGDKMT2AMEN1POLB
SCHEMBL30979013 0.81 TP53 (0.43) MAPTHPGDKDM4EALDH1A1RECQL
SCHEMBL30979029 0.79 TP53 (0.39) MAPTKDM4EALDH1A1TP53LMNA
SCHEMBL30979104 0.79 TP53 (0.36) MAPTKDM4ETP53LMNAPTGS2
SCHEMBL30979022 0.79 EGFR (0.38) MAPTHPGDKDM4EALDH1A1RECQL
SCHEMBL30979073 0.79 ABCG2 (0.41) KDM1AMAPTKDM4EALDH1A1KMT2A
SCHEMBL30978943 0.79 PTAFR (0.38) MAPTHPGDKDM4EALDH1A1RECQL

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
Send feedback