SCHEMBL2982013

SCHEMBL2982013

CSc1ncc(Cl)c(C(=O)NNC(=O)Cc2ccccc2)n1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.59
KDM4E B2RXH2 2/20 0.59
LMNA P02545 2/20 0.59
NPC1 O15118 1/20 0.57
KMT2A Q03164 6/20 0.54
MEN1 O00255 5/20 0.54
ALDH1A1 P00352 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
RXFP1 Q9HBX9 2/20 0.50
RORC P51449 1/20 0.49
TP53 P04637 1/20 0.49
POLB P06746 1/20 0.48
PDCD1 Q15116 1/20 0.48
CD274 Q9NZQ7 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
SCHEMBL2980479 0.76 KMT2A (0.67) MAPTKDM4ELMNANPC1KMT2A
SCHEMBL4144040 0.75 LMNA (0.54) MAPTKDM4ELMNANPC1KMT2A
SCHEMBL7968377 0.74 KMT2A (0.69) MAPTKDM4ELMNANPC1KMT2A
SCHEMBL5192713 0.74 KMT2A (0.78) MAPTKDM4ELMNANPC1KMT2A
SCHEMBL25379870 0.74 MAPT (0.58) MAPTKDM4ELMNANPC1KMT2A
SCHEMBL25379873 0.74 MAPT (0.58) MAPTKDM4ELMNANPC1KMT2A
SCHEMBL9931211 0.72 MAPT (0.81) MAPTKDM4ELMNANPC1KMT2A
SCHEMBL1533879 0.72 KMT2A (1.00) MAPTKDM4ELMNANPC1KMT2A
SCHEMBL14883473 0.70 THRB (0.50) MAPTLMNAKMT2AMEN1ALDH1A1
SCHEMBL2981147 0.70 ALDH1A1 (0.61) MAPTKDM4ELMNANPC1KMT2A

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
EP-1831207-B1 AMINOPYRIMIDINE COMPOUNDS AS PLK INHIBITORS AMGEN INC (US) 2012-11-14 EP disclosed
US-7858785-B2 Aminopyrimidine compounds and methods of use AMGEN INC. (US) 2010-12-28 US disclosed
US-7786132-B2 Aminopyrimidine compounds and methods of use AMGEN INC. (US) 2010-08-31 US disclosed
US-20100010014-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2010-01-14 US disclosed
EP-1831207-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-09-12 EP disclosed
US-20070185133-A1 Aminopyrimidine compounds and methods of use AMGEN, INC. (US) 2007-08-09 US disclosed
WO-2006066172-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN, INC. (US) 2006-06-22 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 (2 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-20100010014-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE PLK1, TYMP, TK2 MAPT 1412/4885KDM4E 1956/4885LMNA 3015/4885
US-20070185133-A1 Aminopyrimidine compounds and methods of use PLK1, TYMP, TK2 MAPT 1412/4885KDM4E 1956/4885LMNA 3015/4885

“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.