SCHEMBL8807969

SCHEMBL8807969

Cc1sc2nccn2c1CCCl

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.43
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
GRM5 P41594 1/20 0.31

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
SCHEMBL8811606 0.76 KDM4E (0.30) KDM4EMEN1ALDH1A1LMNACYP1A2
SCHEMBL3459509 0.71 IDO1 (0.51) IDO1GRM5
SCHEMBL15896797 0.66 IDO1 (0.36) IDO1GRM5
SCHEMBL4016458 0.62 IDO1 (0.39) IDO1MEN1ALDH1A1KMT2AGRM5
SCHEMBL4016456 0.58 IDO1 (0.39) IDO1GRM5
SCHEMBL14788249 0.58 GRM5 (0.38) IDO1GRM5
SCHEMBL21052374 0.58
SCHEMBL12670528 0.58
SCHEMBL275781 0.57 GRM5 (0.43) IDO1KDM4EALDH1A1LMNAKMT2A
SCHEMBL30366148 0.56 MAPT (0.49) IDO1KDM4EALDH1A1LMNACYP1A2

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
EP-0794185-A1 BICYCLIC THIAZOLE COMPOUND MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-09-10 EP disclosed