SCHEMBL9211112

SCHEMBL9211112

O=C1CC=CC2=C1Nc1ccccc1O2

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 9/20 0.44
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
BRD4 O60885 1/20 0.36
CREBBP Q92793 1/20 0.36
PARP1 P09874 1/20 0.35
MAPT P10636 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
GAA P10253 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
DHODH Q02127 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL2143931 0.76 GAA (0.45) ALOX5MEN1KMT2AMAPTGAA
SCHEMBL28517190 0.73 PDGFRA (0.35) MEN1KMT2ABRD4CREBBPMAPT
SCHEMBL29699894 0.71 NTSR1 (0.33) KDM4E
SCHEMBL3667230 0.68 ALOX5 (0.47) ALOX5MEN1KMT2ABRD4CREBBP
SCHEMBL1724752 0.68 ALOX5 (0.43) ALOX5MEN1KMT2ABRD4CREBBP
SCHEMBL10969348 0.65 HTR5A (0.41) MEN1KMT2ABRD4CREBBPMAPT
Phenoxazine SCHEMBL29355714 0.64 ALOX5 (1.00) ALOX5MEN1KMT2APARP1MAPT
Phenoxazine SCHEMBL28844098 0.64 ALOX5 (1.00) ALOX5MEN1KMT2APARP1MAPT
Phenoxazine SCHEMBL6310178 0.64 ALOX5 (1.00) ALOX5MEN1KMT2APARP1MAPT
Phenoxazine SCHEMBL7862 0.64 ALOX5 (1.00) ALOX5MEN1KMT2APARP1MAPT

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-0664810-A1 3,3-DISUBSTITUTED TRI- AND TETRACYCLIC INDOLIN-2-ONES USEFUL FOR THE TREATMENT OF COGNITIVE DISORDERS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1995-08-02 EP disclosed