SCHEMBL11200595

SCHEMBL11200595

c1cc2nnc3ccncc3c2cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.41
ACHE P22303 2/20 0.38
AXL P30530 1/20 0.37
EP300 Q09472 1/20 0.37
KAT2B Q92831 1/20 0.37
KAT8 Q9H7Z6 1/20 0.37
KDM4E B2RXH2 4/20 0.34
HTT P42858 3/20 0.34
KDM4A O75164 1/20 0.34
KDM4B O94953 1/20 0.34
KDM5C P41229 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
KDM3A Q9Y4C1 1/20 0.34
TNF P01375 1/20 0.34
POLB P06746 1/20 0.34
RAD52 P43351 1/20 0.34
EGFR P00533 2/20 0.34
ALDH1A1 P00352 3/20 0.33
CYP1A2 P05177 2/20 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
SCHEMBL11198396 0.88 GPR3 (0.64) GPR3ACHEKDM4EHTTTNF
SCHEMBL27109630 0.79 DHODH (0.36) GPR3ACHEKDM4EPOLBEGFR
SCHEMBL11202057 0.77 KDM4C (0.43) GPR3ACHEAXLEP300KAT2B
SCHEMBL21657940 0.73 DHODH (0.33) ACHEEGFR
SCHEMBL22792591 0.73
SCHEMBL22793043 0.73 DHODH (0.33) ACHEAXL
SCHEMBL11195652 0.72 GPR3 (0.64) GPR3ACHEKDM4EHTTKDM4A
SCHEMBL25461085 0.72 MAPK10 (0.50) GPR3KDM4EHTTTNFPOLB
SCHEMBL18574397 0.71 CCNC (0.39) KDM4EKDM4AKDM4BKDM5CKDM4C
SCHEMBL22304325 0.70 RPS6KA3 (0.34)

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
US-4369318-A USING A BENZO-OR PYRIDO-CINNOLINES AS BLEACH CATALYST CIBA-GEIGY LTD. (CH) 1983-01-18 US disclosed
US-4266011-A FUSED PYRIDAZINE CATALYST CIBA-GEIGY AG (CH) 1981-05-05 US disclosed