SCHEMBL15040306

SCHEMBL15040306

CC(C)c1ccccc1NPNc1ccccc1C(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.52
POLB P06746 1/20 0.47
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
GABRA1 P14867 3/20 0.43
GABRB2 P47870 2/20 0.43
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
FAAH O00519 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL3958491 0.78 L3MBTL1 (0.57) L3MBTL1POLBGRIN2DGRIN3BGRIN1
SCHEMBL9764653 0.78 L3MBTL1 (0.57) L3MBTL1POLBGRIN2DGRIN3BGRIN1
SCHEMBL2737240 0.76 L3MBTL1 (0.55) L3MBTL1POLBGRIN2DGRIN3BGRIN1
SCHEMBL18991348 0.74 L3MBTL1 (0.53) L3MBTL1POLBGRIN2DGRIN3BGRIN1
SCHEMBL15040307 0.74 GABRA1 (0.46) GABRA1GABRB2GABRG2GABRB3FAAH
Hydrochloric Acid SCHEMBL2860733 0.74 L3MBTL1 (0.53) L3MBTL1POLBGRIN2DGRIN3BGRIN1
SCHEMBL6399608 0.74 L3MBTL1 (0.53) L3MBTL1POLBGRIN2DGRIN3BGRIN1
SCHEMBL20743821 0.74 L3MBTL1 (0.53) L3MBTL1POLBGRIN2DGRIN3BGRIN1
SCHEMBL3217546 0.74 L3MBTL1 (0.53) L3MBTL1POLBGRIN2DGRIN3BGRIN1
SCHEMBL892805 0.74 L3MBTL1 (0.53) L3MBTL1POLBGRIN2DGRIN3BGRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8889805-B2 Carboxylate metal complex and catalyst for olefin polymerization SHOWA DENKO K.K. (JP) 2014-11-18 US disclosed
US-20130158223-A1 CARBOXYLATE METAL COMPLEX AND CATALYST FOR OLEFIN POLYMERIZATION THE UNIVERSITY OF TOKYO (JP) 2013-06-20 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-20130158223-A1 CARBOXYLATE METAL COMPLEX AND CATALYST FOR OLEFIN POLYMERIZATION ODC1, AOC2, SCO2 L3MBTL1 4222/4885POLB 538/4885GRIN2D 723/4885

“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.