SCHEMBL7340942

SCHEMBL7340942

COc1cc(NC(=O)c2ccc3cc(C=NN)ccc3c2)cc(OC)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 9/20 0.67
PLG P00747 4/20 0.64
NPC1 O15118 5/20 0.57
RAB9A P51151 4/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
TP53 P04637 2/20 0.57
MEN1 O00255 1/20 0.57
ALDH1A1 P00352 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
GAA P10253 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
KMT2A Q03164 1/20 0.57
HTT P42858 1/20 0.52
CASP3 P42574 2/20 0.51
SENP7 Q9BQF6 2/20 0.51
PTPN11 Q06124 1/20 0.50
PLAT P00750 4/20 0.49

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
SCHEMBL7343249 0.87 STAT3 (0.54) PLAUPLGNPC1RAB9ASMN1; SMN2
SCHEMBL7341753 0.84 MEN1 (0.53) PLAUPLGNPC1RAB9ASMN1; SMN2
SCHEMBL7340171 0.82 RAB9A (0.44) PLAUPLGNPC1RAB9AMEN1
SCHEMBL7336457 0.82 NPC1 (0.53) PLAUPLGNPC1RAB9ASMN1; SMN2
SCHEMBL7341946 0.81 PLAU (0.67) PLAUPLGNPC1RAB9ASMN1; SMN2
SCHEMBL7340329 0.81 PLAU (0.63) PLAUPLGNPC1RAB9ASMN1; SMN2
SCHEMBL7337311 0.81 PLAU (0.58) PLAUPLGNPC1RAB9ASMN1; SMN2
SCHEMBL7337325 0.81 PLAU (0.58) PLAUPLGNPC1RAB9ASMN1; SMN2
SCHEMBL7335937 0.80 DEGS1 (0.57) NPC1RAB9AMEN1KMT2ACASP3
SCHEMBL7341723 0.80 NPC1 (0.48) PLAUPLGNPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6284796-B1 NAPHTHAMIDINE COMPOUNDS ABBOTT LABORATORIES 2001-09-04 US claimed
US-6284796-B1 NAPHTHAMIDINE COMPOUNDS ABBOTT LABORATORIES 2001-09-04 US disclosed