SCHEMBL7334384

SCHEMBL7334384

COc1ccc2cc(/C=C(/Cl)c3cccc(C=C(C)C)c3)ccc2c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.44
RELA Q04206 3/20 0.43
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.41
CYP3A4 P08684 1/20 0.40
MAOB P27338 3/20 0.39
BCHE P06276 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2A6 P11509 1/20 0.39
NQO2 P16083 2/20 0.38

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
SCHEMBL7334386 1.00 PLAU (0.44) PLAURELAMEN1ALDH1A1KMT2A
SCHEMBL7343141 0.85 PLAU (0.59) PLAURELAMEN1ALDH1A1KMT2A
SCHEMBL7336089 0.85 PLAU (0.59) PLAURELAMEN1ALDH1A1KMT2A
SCHEMBL13484115 0.83 CYP1A2 (0.50) RELAMAOBCYP1A2CYP2A6NQO2
SCHEMBL7337316 0.80 PLAU (0.72) PLAU
SCHEMBL7337309 0.80 PLAU (0.72) PLAU
SCHEMBL7335620 0.79 KDM4E (0.53) PLAUMEN1ALDH1A1KMT2ACYP3A4
SCHEMBL7345665 0.78 RELA (0.49) RELAALDH1A1MAOBCYP1A2CYP2A6
SCHEMBL14198012 0.75 CHRM5 (0.58) RELAMEN1ALDH1A1KMT2ACYP3A4
SCHEMBL8845678 0.70 MAPT (0.55) PLAURELAMEN1ALDH1A1KMT2A

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