SCHEMBL3408332

SCHEMBL3408332

Cc1ccc(N)cc1N(C)Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.44
ACHE P22303 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
TSHR P16473 2/20 0.42
ALDH1A1 P00352 2/20 0.42
CSF1R P07333 1/20 0.41
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
CARM1 Q86X55 1/20 0.40
PRMT6 Q96LA8 1/20 0.40
PRMT8 Q9NR22 1/20 0.40
ERAP1 Q9NZ08 1/20 0.39
CYP19A1 P11511 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
CASP1 P29466 1/20 0.38
DHFR P00374 1/20 0.38
TEAD1 P28347 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38

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
SCHEMBL19788684 0.87 ACHE (0.47) AOC3ACHESMN1; SMN2TSHRALDH1A1
SCHEMBL5966724 0.81 ACHE (0.48) AOC3ACHESMN1; SMN2TSHRALDH1A1
SCHEMBL21310342 0.80 MAPT (0.45) AOC3SMN1; SMN2TSHRALDH1A1CSF1R
SCHEMBL13338024 0.79 CYP19A1 (0.44) AOC3ACHESMN1; SMN2TSHRALDH1A1
SCHEMBL450600 0.78 TRPM8 (0.57) AOC3SMN1; SMN2TSHRALDH1A1MAPT
Hydrochloric Acid SCHEMBL30391062 0.77 TRPM8 (0.56) AOC3SMN1; SMN2TSHRALDH1A1MAPT
SCHEMBL15264049 0.77 ALDH1A1 (0.46) ACHESMN1; SMN2TSHRALDH1A1MAPT
SCHEMBL19700140 0.77 AOC3 (0.44) AOC3SMN1; SMN2TSHRALDH1A1CSF1R
SCHEMBL10581787 0.76 MAPT (0.52) ACHETSHRALDH1A1MAPTKMT2A
SCHEMBL11108577 0.75 ACHE (0.49) ACHEALDH1A1MAPTKMT2ACYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2266977-B1 2,4-di[(hetero)arylamino]-pyrimidine derivatives as zap-70 and/or syk inhibitors NOVARTIS AG (CH) 2014-05-14 EP disclosed
US-8283356-B2 2,4- Di(hetero)-arylamino-pyrimidine derivatives as ZAP-70 and/or SYK inhibitors NOVARTIS AG (CH) 2012-10-09 US disclosed
EP-2266977-A1 2,4-di[(hetero)arylamino]-pyrimidine derivatives as zap-70 and/or syk inhibitors Novartis AG (CH) 2010-12-29 EP disclosed
EP-2266977-A1 2,4-di[(hetero)arylamino]-pyrimidine derivatives as zap-70 and/or syk inhibitors Novartis AG (CH) 2010-12-29 EP disclosed
US-20100152182-A1 2,4- Di(hetero)-arylamino-pyrimidine Derivatives as ZAP-70 and/or SYK inhibitors NOVARTIS AG (CH) 2010-06-17 US disclosed
US-7671063-B2 2,4 Di (hetero) -arylamino-pyrimidine derivatives as ZAP-70 and/or syk inhibitors NOVARTIS AG (CH) 2010-03-02 US disclosed
US-20060247262-A1 2,4 Di (hetero) -arylamino-pyrimidine derivatives as ZAP-70 and/or syk inhibitors NOVARTIS AG (CH) 2006-11-02 US disclosed
EP-1664035-A1 2,4 DI (HETERO) -ARYLAMINO-PYRIMIDINE DERIVATIVES AS ZAP-70 AND/OR SYK INHIBITORS Novartis AG (CH) 2006-06-07 EP disclosed
WO-2005026158-A1 2,4 DI (HETERO) -ARYLAMINO-PYRIMIDINE DERIVATIVES AS ZAP-70 AND/OR SYK INHIBITORS NOVARTIS AG (CH) 2005-03-24 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-20100152182-A1 2,4- Di(hetero)-arylamino-pyrimidine Derivatives as ZAP-70 and/or SYK inhibitors ZAP70, SYK, BTK AOC3 3528/4885ACHE 3258/4885SMN1; SMN2 4054/4885
US-20060247262-A1 2,4 Di (hetero) -arylamino-pyrimidine derivatives as ZAP-70 and/or syk inhibitors ZAP70, SYK, BTK AOC3 3609/4885ACHE 3481/4885SMN1; SMN2 4029/4885

“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.