SCHEMBL6202376

SCHEMBL6202376

CCOC(=O)c1cnc2ccc(NCCOC(C)=O)cc2c1O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.50
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
PKM P14618 1/20 0.47
MAPT P10636 8/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
LMNA P02545 4/20 0.46
NPSR1 Q6W5P4 2/20 0.46
GAA P10253 3/20 0.46
KDM4E B2RXH2 1/20 0.46
TP53 P04637 3/20 0.46
PAX8 Q06710 1/20 0.46
ALDH1A1 P00352 3/20 0.45
RXFP1 Q9HBX9 1/20 0.45
HPGD P15428 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL6199162 0.81 MAPT (0.51) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL7929477 0.79 MAPT (0.51) MAPK1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL538115 0.78 NMT1 (0.61) MAPK1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL1467161 0.78 MAPK1 (0.65) MAPK1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6200293 0.78 MAPK1 (0.55) MAPK1MEN1KMT2APKMMAPT
SCHEMBL651326 0.78 PDE5A (0.56) MAPK1MEN1KMT2AMAPTNPSR1
SCHEMBL11066821 0.77 MEN1 (0.51) MAPK1MEN1KMT2APKMMAPT
SCHEMBL1983100 0.76 MAPK1 (0.48) MAPK1MEN1KMT2APKMMAPT
SCHEMBL1616605 0.76 MAPK1 (0.53) MAPK1MEN1KMT2APKMMAPT
SCHEMBL618410 0.76 MAPT (0.62) MEN1KMT2AMAPTSMN1; SMN2LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042295-B1 4-HYDROXYQUINOLINE-3-CARBOXAMIDES AND HYDRAZIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN CO LLC (US) 2005-09-07 EP disclosed
EP-1042295-A1 4-HYDROXYQUINOLINE-3-CARBOXAMIDES AND HYDRAZIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2000-10-11 EP disclosed
US-6093732-A PREVENT HERPESVIRAL INFECTIONS, PARTICULARLY, HUMAN CYTOMEGALOVIRAL INFECTION PHARMACIA & UPJOHN COMPANY (US) 2000-07-25 US disclosed
WO-1999032450-A1 4-HYDROXYQUINOLINE-3-CARBOXAMIDES AND HYDRAZIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 1999-07-01 WO disclosed