SCHEMBL5402411

SCHEMBL5402411

CNc1nc(Nc2cccc(Cl)c2)ncc1N

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 2/20 0.61
▸ JAK2 O60674 2/20 0.55
▸ LRRK2 Q5S007 1/20 0.55
▸ JAK1 P23458 1/20 0.53
▸ JAK3 P52333 1/20 0.53
▸ GRM5 P41594 3/20 0.51
▸ MAOB P27338 2/20 0.51
▸ MAPT P10636 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ IGF1R P08069 1/20 0.50
▸ CAMK2D Q13557 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ HSP90AA1 P07900 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ MAPK1 P28482 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
SCHEMBL5414003 0.83 JAK2 (0.56) SYKJAK2LRRK2GRM5
SCHEMBL5413853 0.83 JAK2 (0.68) SYKJAK2LRRK2JAK3GAA
SCHEMBL5402321 0.82 STK17A (0.55) JAK2LRRK2MAPTMEN1MAPK1
SCHEMBL10998087 0.81 SYK (0.57) SYKJAK2JAK1JAK3GRM5
SCHEMBL2112546 0.79 SYK (0.56) SYKJAK2LRRK2JAK1JAK3
SCHEMBL5413375 0.79 PRKCQ (0.64) SYKJAK2LRRK2JAK1JAK3
SCHEMBL5405530 0.78 L3MBTL1 (0.57) SYKJAK2LRRK2MAPTGAA
SCHEMBL12795913 0.77 CNR2 (0.57) SYKGRM5MAOBCYP1A2CYP3A4
SCHEMBL17915933 0.77 SYK (0.59) SYKJAK2JAK1JAK3GRM5
SCHEMBL5410531 0.76 LRRK2 (0.44) SYKJAK2LRRK2EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7166599-B2 Trisubstituted pyrimidines BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2007-01-23 — — US disclosed
US-20050090486-A1 Trisubstituted pyrimidines BOEHRINGER INGELHEIM PHARMA KG (DE) 2005-04-28 — — US disclosed
US-20030134838-A1 Trisubstituted pyrimidines BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-07-17 — — 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 (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-20030134838-A1 Trisubstituted pyrimidines APP, PSEN1, BACE1 SYK 1842/4885JAK2 4450/4885LRRK2 619/4885
US-20050090486-A1 Trisubstituted pyrimidines APP, BACE1, PSEN1 SYK 818/4885JAK2 4231/4885LRRK2 775/4885

“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.

Send feedback