SCHEMBL15518754

SCHEMBL15518754

N#Cc1cnn2c(NC3CCCC3)c(-c3ccc(Br)cc3)[nH]c12

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.52
▸ TP53 P04637 1/20 0.42
▸ PLAT P00750 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ ALOX5 P09917 1/20 0.35
▸ CSNK2A1 P68400 1/20 0.35
▸ TRIM24 O15164 2/20 0.35
▸ TRIM33 Q9UPN9 1/20 0.35
▸ LPAR1 Q92633 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ PTGES O14684 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ L3MBTL1 Q9Y468 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
SCHEMBL15518216 0.86 MAPT (0.38) MAPTTP53PLATPOLBCSNK2A1
SCHEMBL15518062 0.79 MAPT (0.44) MAPTTP53PLATCSNK2A1GAA
SCHEMBL15519153 0.74 MAPT (0.46) MAPTTP53PLATPOLBCSNK2A1
SCHEMBL2122792 0.74 TBK1 (0.40) MAPTGAAALDH1A1
SCHEMBL15518354 0.74 MAPT (0.58) MAPTPOLBCSNK2A1LPAR1ALDH1A1
SCHEMBL2125438 0.73 KDR (0.41) POLBLPAR1ALDH1A1
SCHEMBL15518351 0.73 MAPT (0.57) MAPTTP53POLBCSNK2A1LPAR1
SCHEMBL15518388 0.73 MAPT (0.47) MAPTCSNK2A1MEN1KMT2A
SCHEMBL15518353 0.73 MAPT (0.49) MAPTTP53POLBCSNK2A1LPAR1
SCHEMBL15518108 0.73 MAPT (0.49) MAPTPOLBCSNK2A1LPAR1MEN1

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-9169215-B2 LPAR—substituted cyanopyrazole compounds HOFFMANN-LA ROCHE INC. (US) 2015-10-27 — — US disclosed
US-20150218106-A1 LPAR - SUBSTITUTED CYANOPYRAZOLE COMPOUNDS HOFFMANN-LA ROCHE INC. 2015-08-06 — — US disclosed
EP-2892882-A1 LPAR - SUBSTITUTED CYANOPYRAZOLE COMPOUNDS F. Hoffmann-La Roche AG (CH) 2015-07-15 — — EP disclosed
WO-2014037303-A1 LPAR - SUBSTITUTED CYANOPYRAZOLE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2014-03-13 — — 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-20150218106-A1 LPAR - SUBSTITUTED CYANOPYRAZOLE COMPOUNDS LPAR3, LPAR1, LPAR2 MAPT 4773/4885TP53 4152/4885PLAT 667/4885

“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.

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