SCHEMBL4039335

SCHEMBL4039335

O=C1c2ccccc2C(=O)N1Cc1cc(Cl)c2cccnc2c1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 4/20 0.60
MAPT P10636 9/20 0.59
KDM4E B2RXH2 8/20 0.59
LMNA P02545 8/20 0.59
TDP1 Q9NUW8 8/20 0.59
SMN1; SMN2 Q16637 7/20 0.59
KMT2A Q03164 6/20 0.59
RAB9A P51151 4/20 0.59
NPSR1 Q6W5P4 4/20 0.59
L3MBTL1 Q9Y468 4/20 0.59
MAPK1 P28482 3/20 0.59
USP2 O75604 2/20 0.59
NOD2 Q9HC29 1/20 0.59
HTT P42858 7/20 0.57
ALDH1A1 P00352 4/20 0.57
MPI P34949 2/20 0.57
HSP90AA1 P07900 5/20 0.56
TP53 P04637 3/20 0.56
ALOX15 P16050 3/20 0.56
ALOX12 P18054 3/20 0.56

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
SCHEMBL11653681 0.81 DRD2 (0.58) MAPTLMNAKMT2AMAPK1USP2
SCHEMBL4039345 0.80 HTT (0.46) MAPTKDM4ELMNATDP1SMN1; SMN2
SCHEMBL11955292 0.78 METAP2 (0.88) METAP2MAPTKDM4ELMNATDP1
SCHEMBL28462402 0.78 KDM4E (0.59) MAPTKDM4ELMNATDP1SMN1; SMN2
SCHEMBL31452761 0.76 METAP2 (0.97) METAP2MAPTKDM4ELMNATDP1
SCHEMBL9996355 0.75 METAP2 (1.00) METAP2MAPTKDM4ELMNATDP1
SCHEMBL10415547 0.74 MAPT (0.66) METAP2MAPTKDM4ELMNATDP1
SCHEMBL10414290 0.74 CDK1 (0.67) METAP2MAPTKDM4ELMNATDP1
SCHEMBL13391489 0.74 MAPT (1.00) METAP2MAPTKDM4ELMNATDP1
SCHEMBL2014459 0.74 CDK1 (0.62) METAP2MAPTKDM4ELMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2079699-A1 QUINOLINE DERIVATIVES Envivo Pharmaceuticals, Inc. (US) 2009-07-22 EP disclosed
WO-2008014602-A1 QUINOLINE DERIVATIVES ENVIVO PHARMACEUTICALS, INC. (US) 2008-02-07 WO disclosed
WO-2008014602-A1 QUINOLINE DERIVATIVES ENVIVO PHARMACEUTICALS, INC. (US) 2008-02-07 WO disclosed