SCHEMBL10024970

SCHEMBL10024970

NCP(Cc1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.44
HTR2A P28223 2/20 0.41
TAAR1 Q96RJ0 2/20 0.41
CYP2A6 P11509 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAOA P21397 2/20 0.37
CYP3A4 P08684 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
CALM1 P0DP23 1/20 0.36
IDO1 P14902 3/20 0.34
EPHX2 P34913 1/20 0.34
EPHX1 P07099 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
MAPT P10636 1/20 0.33
TP53 P04637 1/20 0.33
MAOB P27338 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL4250554 0.85 TDP1 (0.43) LOXL2HTR2ATAAR1CYP2A6SMN1; SMN2
SCHEMBL27522009 0.82 LTA4H (0.50) TAAR1IDO1MAOB
SCHEMBL14609301 0.81 TDP1 (0.39) LOXL2HTR2ATAAR1CYP2A6SMN1; SMN2
SCHEMBL9883762 0.81 TDP1 (0.39) LOXL2HTR2ATAAR1CYP2A6SMN1; SMN2
SCHEMBL15660615 0.80 CALM1 (0.43) LOXL2HTR2ATAAR1CYP2A6SMN1; SMN2
SCHEMBL14609303 0.77 CYP3A4 (0.36) LOXL2MAOACYP3A4TDP1CALM1
SCHEMBL9883769 0.77 CYP3A4 (0.36) LOXL2MAOACYP3A4TDP1CALM1
SCHEMBL9883764 0.77 CYP3A4 (0.36) LOXL2MAOACYP3A4TDP1CALM1
SCHEMBL11657225 0.77 CYP3A4 (0.36) LOXL2SMN1; SMN2CYP3A4TDP1CALM1
SCHEMBL4242743 0.77 TP53 (0.44) LOXL2SMN1; SMN2CYP3A4TDP1CALM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8716508-B2 Method for preparing a metal catalyst KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2014-05-06 US disclosed
CN-102428156-A Method of treating borehole and drilling fluid MONTANUNIV LEOBEN 2012-04-25 CN disclosed
US-20120046479-A1 METHOD FOR PREPARING A METAL CATALYST KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2012-02-23 US disclosed
CN-101933104-A Magnetic ion liquid is as the purposes of extractant PROIONIC PRODUCTION OF IONIC S 2010-12-29 CN 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-20120046479-A1 METHOD FOR PREPARING A METAL CATALYST INPP5B, DNPEP, AOC1 LOXL2 4445/4885HTR2A 2055/4885TAAR1 494/4885

“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.