SCHEMBL30979029

SCHEMBL30979029

C=C(C)c1ccc2c(Nc3ccccc3)nc3nnc(C)n3c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 4/20 0.39
▸ POLB P06746 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ CSNK2A1 P68400 4/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ CSNK2A2 P19784 1/20 0.37
▸ CSNK2B P67870 1/20 0.37
▸ SLC2A1 P11166 1/20 0.36
▸ BRD4 O60885 3/20 0.36
▸ NPY5R Q15761 2/20 0.36
▸ THRB P10828 1/20 0.35
▸ EGFR P00533 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ USP2 O75604 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ ALOX15 P16050 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
SCHEMBL30979076 0.83 EGFR (0.42) TP53POLBTDP1LMNAMAPT
SCHEMBL30979115 0.82 KDM4E (0.46) TP53POLBTDP1LMNAMAPT
SCHEMBL30979068 0.82 TP53 (0.38) TP53POLBTDP1CSNK2A1LMNA
SCHEMBL30979104 0.82 TP53 (0.36) TP53POLBTDP1LMNAMAPT
SCHEMBL30979013 0.81 TP53 (0.43) TP53POLBTDP1LMNAMAPT
SCHEMBL30978943 0.80 PTAFR (0.38) TP53POLBTDP1LMNAMAPT
SCHEMBL30979073 0.80 ABCG2 (0.41) TP53TDP1MAPTKDM4EEGFR
SCHEMBL30979022 0.80 EGFR (0.38) TP53POLBTDP1LMNAMAPT
SCHEMBL30978940 0.79 LATS1 (0.43) TP53POLBTDP1CSNK2A1LMNA
SCHEMBL30979121 0.79 KDM1A (0.46) TP53POLBTDP1LMNAMAPT

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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