SCHEMBL11028620

SCHEMBL11028620

Cc1cc([N+](=O)[O-])ccc1Oc1ccc(Cl)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
LMNA P02545 3/20 0.53
GAA P10253 1/20 0.46
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
ESRRA P11474 3/20 0.45
ALDH1A1 P00352 3/20 0.45
TDP1 Q9NUW8 3/20 0.45
HSD17B10 Q99714 1/20 0.45
TSHR P16473 1/20 0.45
CYP3A4 P08684 2/20 0.44
NPC1 O15118 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 0.44
CYP2C19 P33261 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 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
SCHEMBL10962765 0.87 MAPT (0.56) MAPTLMNAGAAKMT2AMEN1
SCHEMBL10963006 0.86 MAPT (0.50) MAPTLMNAGAAKMT2AMEN1
SCHEMBL10961730 0.86 TDP1 (0.51) MAPTLMNAKMT2AMEN1ALDH1A1
SCHEMBL11029230 0.85 MAPT (0.52) MAPTLMNAKMT2AMEN1ESRRA
SCHEMBL22114316 0.85 HPGD (0.56) MAPTLMNAGAAKMT2AMEN1
SCHEMBL11030421 0.84 MAPT (0.48) MAPTLMNAGAAKMT2AMEN1
SCHEMBL11031492 0.83 LMNA (0.58) MAPTLMNAGAAKMT2AMEN1
SCHEMBL9185260 0.82 ALDH1A1 (0.64) MAPTLMNAGAAKMT2AMEN1
SCHEMBL11030748 0.82 ALOX5 (0.52) MAPTLMNAGAAKMT2AMEN1
SCHEMBL10990381 0.82 LMNA (0.46) MAPTLMNAGAAKMT2AMEN1

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-4426385-A Insecticidal bicyclooxyphenyl ureas UNION CARBIDE CORPORATION (US) 1984-01-17 US disclosed
EP-0050321-A2 Novel bicyclooxyphenyl ureas, process for their preparation and pesticides containing them UNION CARBIDE CORPORATION (US) 1982-04-28 EP disclosed