SCHEMBL14612005

SCHEMBL14612005

Cc1ccc2c(c1)nnc1ccccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.61
NQO2 P16083 1/20 0.54
LMNA P02545 2/20 0.44
KIF11 P52732 1/20 0.44
MAOA P21397 1/20 0.42
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPT P10636 2/20 0.41
TDP2 O95551 1/20 0.41
NSD2 O96028 1/20 0.41
POLB P06746 1/20 0.41
BLM P54132 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CYP1A2 P05177 3/20 0.41
GAA P10253 1/20 0.40
NPC1 O15118 1/20 0.39

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
SCHEMBL30895366 1.00 GPR3 (0.61) GPR3NQO2LMNAKIF11MAOA
SCHEMBL2756743 0.89 CYP1A2 (0.46) GPR3NQO2LMNAALDH1A1KDM4E
SCHEMBL14627008 0.87 GPR3 (0.61) GPR3NQO2LMNAMAOAALDH1A1
SCHEMBL29216865 0.84 GPR3 (0.52) GPR3LMNAALDH1A1KDM4EMEN1
SCHEMBL30895365 0.81 GPR3 (0.48) GPR3LMNAALDH1A1MEN1KMT2A
SCHEMBL29216859 0.81 GPR3 (0.48) GPR3LMNAALDH1A1MEN1KMT2A
SCHEMBL29216866 0.81 GPR3 (0.44) GPR3NQO2LMNAALDH1A1KDM4E
Benzonaphthyridine SCHEMBL30897319 0.78 GPR3 (1.00) GPR3NQO2LMNAMAOAALDH1A1
Benzonaphthyridine SCHEMBL51197 0.78 GPR3 (1.00) GPR3NQO2LMNAMAOAALDH1A1
Benzonaphthyridine SCHEMBL29600756 0.78 GPR3 (1.00) GPR3NQO2LMNAMAOAALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118084804-A Preparation method of benzo [ c ] cinnoline compound 中科中山药物创新研究院 2024-05-28 CN disclosed
US-7179879-B2 Poly(arylene ether) dielectrics CHARTERED SEMICONDUCTOR MANUFACTURING LTD. (SG) 2007-02-20 US disclosed