SCHEMBL4171886

SCHEMBL4171886

Cc1ccc(Nc2ccc3ccccc3c2)c(C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
HPGD P15428 3/20 0.52
ALDH1A1 P00352 3/20 0.52
CYP3A4 P08684 3/20 0.52
HSD17B10 Q99714 3/20 0.52
RAPGEF4 Q8WZA2 1/20 0.50
RAB9A P51151 5/20 0.47
NPC1 O15118 4/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
GAA P10253 1/20 0.46
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAP2K2 P36507 1/20 0.44
MAP2K1 Q02750 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
SCHEMBL1011046 0.84 ALDH1A1 (0.57) CYP2A6TDP1HPGDALDH1A1CYP3A4
SCHEMBL6696006 0.82 ALDH1A1 (0.59) CYP2A6TDP1HPGDALDH1A1CYP3A4
SCHEMBL17794436 0.82 ALDH1A1 (0.59) CYP2A6TDP1HPGDALDH1A1CYP3A4
SCHEMBL20342387 0.82 CYP2A6 (0.68) CYP2A6TDP1HPGDALDH1A1CYP3A4
SCHEMBL1921159 0.81 RAPGEF4 (0.65) TDP1HPGDALDH1A1RAPGEF4RAB9A
SCHEMBL29445703 0.81 RAPGEF4 (0.65) TDP1HPGDALDH1A1RAPGEF4RAB9A
SCHEMBL1011514 0.80 HPGD (0.73) CYP2A6TDP1HPGDALDH1A1CYP3A4
SCHEMBL29489400 0.80 HPGD (0.73) CYP2A6TDP1HPGDALDH1A1CYP3A4
SCHEMBL29473561 0.80 GAA (0.62) TDP1HPGDRAPGEF4RAB9ANPC1
SCHEMBL429859 0.80 GAA (0.62) TDP1HPGDRAPGEF4RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9748493-B2 Aromatic amine-terphenyl compounds and use thereof in organic semiconducting components NOVALED GMBH (DE) 2017-08-29 US disclosed
US-20150011795-A1 Aromatic Amine-Terphenyl Compounds and Use Thereof in Organic Semiconducting Components NOVALED GMBH (DE) 2015-01-08 US disclosed
US-8354211-B2 Electrophotographic photoreceptor, image forming apparatus and process cartridge SHARP KABUSHIKI KAISHA (JP) 2013-01-15 US disclosed
US-8354211-B2 Electrophotographic photoreceptor, image forming apparatus and process cartridge SHARP KABUSHIKI KAISHA (JP) 2013-01-15 US disclosed
US-8354211-B2 Electrophotographic photoreceptor, image forming apparatus and process cartridge SHARP KABUSHIKI KAISHA (JP) 2013-01-15 US disclosed
US-20090175650-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, IMAGE FORMING APPARATUS AND PROCESS CARTRIDGE SHARP KABUSHIKI KAISHA (JP) 2009-07-09 US disclosed
US-20090175650-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, IMAGE FORMING APPARATUS AND PROCESS CARTRIDGE SHARP KABUSHIKI KAISHA (JP) 2009-07-09 US disclosed
US-20090175650-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, IMAGE FORMING APPARATUS AND PROCESS CARTRIDGE SHARP KABUSHIKI KAISHA (JP) 2009-07-09 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 (1 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-20090175650-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, IMAGE FORMING APPARATUS AND PROCESS CARTRIDGE NR2E3, ARRB1, ALDH1A2 CYP2A6 1159/4885TDP1 3285/4885HPGD 2979/4885

“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.