SCHEMBL4037192

SCHEMBL4037192

O=C(Cc1ccccn1)Nc1ccc2cccc(O)c2n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.56
TDP1 Q9NUW8 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
ALOX12 P18054 2/20 0.56
TSHR P16473 2/20 0.56
KMT2A Q03164 2/20 0.56
HTT P42858 2/20 0.56
KDM4E B2RXH2 1/20 0.56
NPC1 O15118 1/20 0.56
TP53 P04637 1/20 0.56
ALOX15 P16050 1/20 0.56
RAB9A P51151 1/20 0.56
KLF5 Q13887 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA5A P35218 1/20 0.48
CA7 P43166 1/20 0.48
CA5B Q9Y2D0 1/20 0.48
MKNK1 Q9BUB5 1/20 0.45

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
SCHEMBL4035524 0.79 NPC1 (0.62) LMNATDP1SMN1; SMN2ALOX12TSHR
SCHEMBL7931752 0.78 KMT2A (0.49) LMNATDP1SMN1; SMN2ALOX12TSHR
SCHEMBL4034766 0.76 NLRP3 (0.51) LMNATDP1SMN1; SMN2ALOX12TSHR
SCHEMBL4041685 0.75 POLB (0.62) LMNATDP1SMN1; SMN2KMT2AHTT
SCHEMBL7692175 0.73 EGLN1 (0.64) LMNATDP1SMN1; SMN2ALOX12TSHR
SCHEMBL16879461 0.73 CA1 (0.49) KMT2AHTTRAB9ACA1CA2
SCHEMBL9311156 0.73 KDM4E (0.57) LMNATDP1SMN1; SMN2ALOX12TSHR
SCHEMBL8342468 0.73 KDM4E (0.60) LMNATDP1SMN1; SMN2ALOX12TSHR
SCHEMBL8342587 0.73 ALOX12 (1.00) LMNATDP1SMN1; SMN2ALOX12TSHR
SCHEMBL16603426 0.73 ALOX12 (0.52) LMNATDP1SMN1; SMN2ALOX12TSHR

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