SCHEMBL624828

SCHEMBL624828

Oc1ccccc1C=Nc1ccc2ccccc2c1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.63
POLB P06746 3/20 0.63
CA12 O43570 1/20 0.61
CA2 P00918 1/20 0.61
CA9 Q16790 1/20 0.61
SIRT2 Q8IXJ6 1/20 0.56
CRHBP P24387 1/20 0.55
CRHR2 Q13324 1/20 0.55
KMT2A Q03164 7/20 0.53
MEN1 O00255 6/20 0.53
ALDH1A1 P00352 5/20 0.53
MAPT P10636 5/20 0.53
KDM4E B2RXH2 3/20 0.53
ATM Q13315 2/20 0.53
GAA P10253 2/20 0.53
DHODH Q02127 1/20 0.52
RECQL P46063 2/20 0.48
TDP2 O95551 1/20 0.48
THRB P10828 1/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL10049044 1.00 L3MBTL1 (0.63) L3MBTL1POLBCA12CA2CA9
SCHEMBL15377777 0.98 L3MBTL1 (0.61) L3MBTL1POLBCA12CA2CA9
SCHEMBL27214734 0.87 CA12 (0.61) L3MBTL1POLBCA12CA2CA9
SCHEMBL29862789 0.87 CA12 (0.61) L3MBTL1POLBCA12CA2CA9
SCHEMBL12786273 0.87 CA12 (0.61) L3MBTL1POLBCA12CA2CA9
SCHEMBL12809855 0.83 L3MBTL1 (0.82) L3MBTL1POLBCA12CA2CA9
SCHEMBL12786260 0.83 CA12 (0.56) L3MBTL1POLBCA12CA2CA9
SCHEMBL10049041 0.81 KMT2A (0.74) L3MBTL1POLBCRHBPCRHR2KMT2A
SCHEMBL13051325 0.80 POLB (0.76) L3MBTL1POLBCA12CA2CA9
SCHEMBL5357087 0.79 CRHBP (0.60) L3MBTL1POLBCA12CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9199924-B2 Process for the preparation of urethanes BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-01 US disclosed
EP-2603319-B1 PROCESS FOR THE PREPARATION OF URETHANS BAYER IP GMBH (DE) 2014-10-22 EP disclosed
US-20130303740-A1 METHOD FOR PRODUCING URETHANES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-11-14 US disclosed
EP-2603319-A1 METHOD FOR PRODUCING URETHANES Bayer Intellectual Property GmbH (DE) 2013-06-19 EP disclosed
WO-2012020028-A1 METHOD FOR PRODUCING URETHANES BAYER MATERIALSCIENCE AG (DE) 2012-02-16 WO 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-20130303740-A1 METHOD FOR PRODUCING URETHANES SOD1, AOC2, DUOX2 L3MBTL1 3308/4885POLB 574/4885CA12 239/4885

“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.