SCHEMBL7913323

SCHEMBL7913323

Clc1ccc(Oc2nnc(-c3ccccc3)c3ccccc23)cc1

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.73
NPSR1 Q6W5P4 5/20 0.73
MEN1 O00255 5/20 0.73
HTT P42858 4/20 0.73
ALDH1A1 P00352 4/20 0.73
LMNA P02545 3/20 0.73
MAPT P10636 2/20 0.73
SMN1; SMN2 Q16637 2/20 0.66
FLT1 P17948 1/20 0.52
KDR P35968 1/20 0.52
HPGD P15428 2/20 0.46
ADORA2A P29274 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
TP53 P04637 1/20 0.45
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP3A4 P08684 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
SCHEMBL27965124 0.89 KMT2A (0.79) KMT2ANPSR1MEN1HTTALDH1A1
SCHEMBL7904930 0.84 NPSR1 (1.00) KMT2ANPSR1MEN1HTTALDH1A1
SCHEMBL7915167 0.84 HTT (0.73) KMT2ANPSR1MEN1HTTALDH1A1
SCHEMBL7914973 0.84 NPSR1 (0.73) KMT2ANPSR1MEN1HTTALDH1A1
SCHEMBL7914925 0.84 NPSR1 (0.78) KMT2ANPSR1MEN1HTTALDH1A1
SCHEMBL7904890 0.84 NPSR1 (0.61) KMT2ANPSR1MEN1HTTALDH1A1
SCHEMBL7918574 0.81 NPSR1 (0.72) KMT2ANPSR1MEN1HTTALDH1A1
SCHEMBL7918635 0.81 HTT (0.72) KMT2ANPSR1MEN1HTTALDH1A1
SCHEMBL7912126 0.81 KMT2A (0.68) KMT2ANPSR1MEN1HTTALDH1A1
SCHEMBL7918468 0.81 NPSR1 (0.69) KMT2ANPSR1MEN1HTTALDH1A1

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
US-6207666-B1 TREATING PRECANCEROUS LESIONS BY ADMINISTERING 4-PHENYLPHTHALAZINE DERIVATIVE CELL PATHWAYS, INC. 2001-03-27 US disclosed