SCHEMBL5750867

SCHEMBL5750867

CCCCCCc1ccnc(Nc2cccc3ccccc23)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.41
MAPK10 P53779 2/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RORA P35398 1/20 0.38
RORC P51449 1/20 0.38
RORB Q92753 1/20 0.38
MAPK8 P45983 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MEN1 O00255 1/20 0.38
CNR1 P21554 1/20 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
SCHEMBL5775211 0.91 MAPK10 (0.38) TRPV1MAPK10MAPTKDM4EMAPK8
SCHEMBL5769845 0.91 MAPK10 (0.38) TRPV1MAPK10MAPTKDM4EMAPK8
SCHEMBL5774799 0.91 MAPK10 (0.38) TRPV1MAPK10MAPTKDM4EMAPK8
SCHEMBL5776450 0.85 MAPK10 (0.40) TRPV1MAPK10MAPTKMT2AKDM4E
SCHEMBL5747295 0.85 KDM4E (0.36) TRPV1MAPTKDM4EALDH1A1HPGD
SCHEMBL5748751 0.85 KDM4E (0.36) TRPV1MAPTKDM4EALDH1A1HPGD
SCHEMBL5749596 0.85 KDM4E (0.36) TRPV1MAPTKDM4EALDH1A1HPGD
SCHEMBL5914010 0.84 MAPT (0.43) TRPV1MAPTKDM4EL3MBTL1RORA
SCHEMBL5779245 0.84 MAPT (0.43) TRPV1MAPTKDM4EL3MBTL1RORA
SCHEMBL5775624 0.84 MAPT (0.43) TRPV1MAPTKDM4EL3MBTL1RORA

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-20060293503-A1 Polyaminopyridines and method for producing same SUMITOMO SEIKA CHEMICALS CO., LTD (JP) 2006-12-28 US disclosed
EP-1669390-A1 POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2006-06-14 EP disclosed