SCHEMBL9971876

SCHEMBL9971876

Clc1c2ccccc2c(/C=C/c2ccccc2)c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 3/20 0.47
MAOB P27338 4/20 0.42
MAOA P21397 3/20 0.41
CYP19A1 P11511 2/20 0.41
NR1H2 P55055 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
RECQL P46063 1/20 0.39
RAB9A P51151 1/20 0.39
CHAT P28329 2/20 0.39
RELA Q04206 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
TRPA1 O75762 1/20 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
SCHEMBL4304901 0.89 NFE2L2 (0.56) NFE2L2MAOBMAOACYP19A1MEN1
SCHEMBL4304905 0.89 NFE2L2 (0.56) NFE2L2MAOBMAOACYP19A1MEN1
SCHEMBL30129708 0.89 NFE2L2 (0.56) NFE2L2MAOBMAOACYP19A1MEN1
SCHEMBL4288335 0.86 NFE2L2 (0.54) NFE2L2MAOBMAOACYP19A1MEN1
SCHEMBL13897092 0.84 APP (0.46) NFE2L2MAOBMAOACYP19A1MEN1
SCHEMBL9971852 0.78 MAOB (0.52) NFE2L2MAOBMAOACYP19A1MEN1
SCHEMBL28618279 0.77 KMT2A (0.49) NFE2L2MAOBMAOACYP19A1MEN1
SCHEMBL28763472 0.77 NFE2L2 (0.45) NFE2L2MAOBMAOACYP19A1MEN1
SCHEMBL28604671 0.77 CYP19A1 (0.75) NFE2L2MAOBMAOACYP19A1RELA
SCHEMBL31312541 0.76 MEN1 (0.41) MAOBMAOAMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120153815-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 US disclosed
US-20120153815-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 US disclosed
US-20110175521-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2011-07-21 US disclosed
US-20110175521-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2011-07-21 US disclosed
US-20100160687-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-06-24 US disclosed
US-20100160687-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-06-24 US disclosed
US-20070142671-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD (JP) 2007-06-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110175521-A1 ORGANIC ELECTROLUMESCENCE DEVICE SCO2, CHRM1, CHRM4 NFE2L2 253/4885MAOB 739/4885MAOA 1500/4885
US-20100160687-A1 ORGANIC ELECTROLUMESCENCE DEVICE SCO2, CHRM1, CHRM4 NFE2L2 253/4885MAOB 739/4885MAOA 1500/4885
US-20120153815-A1 ORGANIC ELECTROLUMINESCENCE DEVICE ARL1, RIF1, EML4 NFE2L2 611/4885MAOB 1485/4885MAOA 1025/4885
US-20070142671-A1 ORGANIC ELECTROLUMESCENCE DEVICE SCO2, CHRM1, CHRM4 NFE2L2 253/4885MAOB 739/4885MAOA 1500/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.