SCHEMBL10692546

SCHEMBL10692546

Nc1cc2cc(F)c(F)cc2cc1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.44
ALDH1A1 P00352 1/20 0.39
GPR84 Q9NQS5 1/20 0.35
CHEK1 O14757 1/20 0.33
MAPT P10636 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 2/20 0.32
NPC1 O15118 1/20 0.32
USP2 O75604 1/20 0.32
CACNA1B Q00975 1/20 0.32
APBA1 Q02410 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31

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
SCHEMBL29363736 0.82 PTK2 (0.54) PTK2ALDH1A1MAPTMEN1KMT2A
SCHEMBL102552 0.82 PTK2 (0.54) PTK2ALDH1A1MAPTMEN1KMT2A
SCHEMBL29429002 0.82 PTK2 (0.64) PTK2ALDH1A1CHEK1MAPTMEN1
SCHEMBL1599775 0.82 PTK2 (0.64) PTK2ALDH1A1CHEK1MAPTMEN1
SCHEMBL10710404 0.82 GPR84 (0.43) GPR84
Hydrochloric Acid SCHEMBL10335452 0.79 PTK2 (0.50) PTK2ALDH1A1MEN1KMT2ATDP1
Hydrochloric Acid SCHEMBL10335450 0.79 PTK2 (0.50) PTK2ALDH1A1MEN1KMT2ATDP1
SCHEMBL5605593 0.78 PTK2 (0.58) PTK2ALDH1A1CHEK1MAPTMEN1
SCHEMBL29516961 0.78 PTK2 (0.58) PTK2ALDH1A1CHEK1MAPTMEN1
SCHEMBL8912022 0.78 GPR84 (0.41) GPR84

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-4792508-A STEREOISOMERIC NAPHTHALENE IMIDAZOLE PERYLENES, ARYL AMINES XEROX CORPORATION (US) 1988-12-20 US disclosed