SCHEMBL30979106

SCHEMBL30979106

Cc1nnc2nc(Nc3ccccc3)c3cc(-c4ccncc4)ccc3n12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LATS1 O95835 3/20 0.43
▸ KDM4E B2RXH2 5/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ HPGD P15428 3/20 0.43
▸ POLB P06746 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ PDE5A O76074 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.41
▸ ALK Q9UM73 1/20 0.40
▸ BRD4 O60885 1/20 0.38
▸ LMNA P02545 3/20 0.38
▸ GSK3A P49840 1/20 0.38
▸ GSK3B P49841 1/20 0.38
▸ ABCG2 Q9UNQ0 4/20 0.38
▸ TGFBR1 P36897 2/20 0.38
▸ ABCB1 P08183 1/20 0.38
▸ MAPK14 Q16539 1/20 0.38
▸ CSNK2A1 P68400 1/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37

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
SCHEMBL30978940 0.91 LATS1 (0.43) LATS1KDM4EALDH1A1HPGDPOLB
SCHEMBL30979119 0.86 LATS1 (0.43) LATS1KDM4EALDH1A1HPGDPOLB
SCHEMBL30979115 0.84 KDM4E (0.46) KDM4EALDH1A1POLBSMN1; SMN2PDE5A
SCHEMBL30979053 0.82 ALDH1A1 (0.44) KDM4EALDH1A1HPGDPOLBSMN1; SMN2
SCHEMBL30979013 0.81 TP53 (0.43) KDM4EALDH1A1HPGDPOLBPDE5A
SCHEMBL30979048 0.80 CYP1A2 (0.47) KDM4EALDH1A1HPGDSMN1; SMN2PDE5A
SCHEMBL31169427 0.79 TP53 (0.36) KDM4EALDH1A1POLBPDE5ARXFP1
SCHEMBL30978977 0.78 KDM4E (0.38) KDM4EPOLBCSNK2A1TP53MAPT
SCHEMBL30979014 0.77 ABCG2 (0.52) POLBSMN1; SMN2PDE5AABCG2MEN1
SCHEMBL30979076 0.75 EGFR (0.42) KDM4EALDH1A1POLBRXFP1BRD4

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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