SCHEMBL7477564

SCHEMBL7477564

NCCOC1=c2ccccc2=NC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.41
KDM4E B2RXH2 1/20 0.41
LTA4H P09960 2/20 0.37
PLA2G2A P14555 1/20 0.37
HTR1B P28222 1/20 0.35
TP53 P04637 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
MAPT P10636 3/20 0.34
KMT2A Q03164 3/20 0.34
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 2/20 0.34
POLB P06746 2/20 0.34
LMNA P02545 2/20 0.34
PKM P14618 1/20 0.34
MAPK10 P53779 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
NLRP3 Q96P20 1/20 0.34
TGM2 P21980 1/20 0.33
GAA P10253 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
SCHEMBL28134315 0.82 ALDH1A1 (0.39) MAPTKMT2AALDH1A1MEN1POLB
SCHEMBL28890950 0.74 ALDH1A1 (0.38) MAPTKMT2AALDH1A1MEN1POLB
SCHEMBL28728640 0.72 MAPT (0.41) KDM4EMAPK1MAPTKMT2AALDH1A1
SCHEMBL30825761 0.72 MAPT (0.40) KDM4ETP53MAPK1RAB9AMAPT
SCHEMBL22410854 0.71 MAPT (0.36) TAAR1MAPTKMT2AALDH1A1MEN1
Hydrochloric Acid SCHEMBL29143517 0.69 MAPT (0.36) MAPK1MAPTKMT2AALDH1A1MEN1
SCHEMBL9139763 0.67 ATM (0.41) MAPK1MAPTKMT2AALDH1A1MEN1
SCHEMBL1137916 0.67 MAPT (0.40) KDM4EMAPK1MAPTKMT2AALDH1A1
SCHEMBL3520478 0.67 ATM (0.38) MAPK1MAPTKMT2AALDH1A1MEN1
SCHEMBL6866868 0.67 MAPT (0.43) KDM4ETP53MAPK1RAB9AMAPT

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-0923551-B1 4-AMINOETHOXY INDOLONE DERIVATIVES AMERICAN HOME PROD (US) 2002-06-05 EP disclosed