SCHEMBL4690140

SCHEMBL4690140

NN(c1ccccc1)c1cc[nH]n1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.32
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
POLB P06746 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
SCHEMBL10418486 0.78 POLB (0.40) NPSR1ALDH1A1KDM4ECYP1A2CYP3A4
SCHEMBL17674048 0.75 DHFR (0.42)
SCHEMBL28733031 0.75 NPSR1 (0.32) NPSR1ALDH1A1CYP2D6TDP1L3MBTL1
SCHEMBL398536 0.72 NPSR1 (0.44) NPSR1ALDH1A1TDP1L3MBTL1POLB
SCHEMBL1792016 0.71 ALDH1A1 (0.46) NPSR1ALDH1A1KDM4ECYP1A2CYP3A4
SCHEMBL193916 0.71 ALDH1A1 (0.46) NPSR1ALDH1A1KDM4ECYP1A2CYP3A4
SCHEMBL4458935 0.71 NPSR1 (0.47) NPSR1ALDH1A1MAPTTDP1L3MBTL1
SCHEMBL1667246 0.71 ALDH1A1 (0.38) ALDH1A1POLB
SCHEMBL11191178 0.71 GOT1 (0.34)
SCHEMBL17049294 0.71 POLB (0.32) POLB

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
CN-100435027-C Organic light receptor with charge transfer compound for electronic photographing SAMSUNG ELECTRONICS CO LTD (KR) 2008-11-19 CN disclosed
EP-1283448-B1 Electrophotographic organophotoreceptors with charge transport compounds SAMSUNG ELECTRONICS CO LTD (KR) 2008-11-05 EP disclosed
US-7358014-B2 Electrophotographic organophotoreceptors with novel charge transport compounds SAMSUNG ELECTRONICS CO., LTD. (KR) 2008-04-15 US disclosed
US-20050112490-A1 Electrophotographic organophotoreceptors with novel charge transport compounds SAMSUNG ELECTRONICS CO., LTD. 2005-05-26 US disclosed
US-20030113132-A1 Electrophotographic organophotoreceptors with novel charge transport compounds SAMSUNG INFORMATION SYSTEMS AMERICA 2003-06-19 US disclosed
CN-1410834-A Organic light receptor with charge transfer compound for electronic photographing SAMSUNG ELECTRONICS CO LTD (KR) 2003-04-16 CN disclosed
EP-1283448-A2 Electrophotographic organophotoreceptors with charge transport compounds Samsung Electronics Co., Ltd. (KR) 2003-02-12 EP 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-20030113132-A1 Electrophotographic organophotoreceptors with novel charge transport compounds SLC43A1, SLC18A2, SLC1A1 NPSR1 240/4885ALDH1A1 1216/4885KDM4E 3796/4885

“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.