SCHEMBL27445169

SCHEMBL27445169

Cc1cnncc1-c1ccccc1.c1ccc(Cc2ccnnc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 5/20 0.41
CYP11B2 P19099 5/20 0.41
LOXL2 Q9Y4K0 1/20 0.37
CALM1 P0DP23 1/20 0.36
KCNQ2 O43526 1/20 0.36
CYP3A4 P08684 1/20 0.34
RAB9A P51151 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
NPC1 O15118 2/20 0.33
PTPN1 P18031 1/20 0.33
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
AKT1 P31749 1/20 0.33
AKT2 P31751 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL1985814 0.82 CALM1 (0.55) CYP11B1CYP11B2LOXL2CALM1KCNQ2
SCHEMBL7074403 0.80 AKT1 (0.47) RAB9ASMN1; SMN2NPC1AKT1AKT2
SCHEMBL27445172 0.78 CYP11B1 (0.40) CYP11B1CYP11B2LOXL2CALM1KCNQ2
SCHEMBL18590773 0.67 LOXL2 (0.52) LOXL2KCNQ2CYP3A4SMN1; SMN2HPGD
SCHEMBL9562370 0.65 ESR2 (0.53) CALM1PTPN1L3MBTL1
SCHEMBL1772471 0.64 LOXL2 (0.48) CYP11B1CYP11B2LOXL2KCNQ2CYP3A4
SCHEMBL22609293 0.64 LOXL2 (0.48) CYP11B1CYP11B2LOXL2CYP3A4SMN1; SMN2
SCHEMBL21647021 0.64 LOXL2 (0.44) LOXL2KCNQ2HSD17B10
Diphenylmethane SCHEMBL10336493 0.63 CALM1 (0.80) LOXL2CALM1RAB9ASMN1; SMN2NPC1
SCHEMBL10933007 0.62 PNMT (0.46) CYP11B1CYP11B2LOXL2CYP3A4HPGD

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-1118793-A Latent catalysts, cure-inhibited epxoy resin compositions and laminates prepared therefrom DOW CHEMICAL CO (US) 1996-03-20 CN disclosed