SCHEMBL17005802

SCHEMBL17005802

NC(=O)c1cnc(Nc2ccc3c(c2)CN(S(=O)(=O)Cc2ccccc2)CC3)nc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 10/20 0.63
OPRK1 P41145 3/20 0.45
OPRM1 P35372 2/20 0.45
OPRD1 P41143 2/20 0.45
CHEK1 O14757 2/20 0.42
FLT3 P36888 2/20 0.42
HDAC1 Q13547 1/20 0.41
RORC P51449 1/20 0.41

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
SCHEMBL17005771 0.83 OPRM1 (0.62) SYKOPRK1OPRM1OPRD1
SCHEMBL18351925 0.78 SYK (1.00) SYK
SCHEMBL18351923 0.78 SYK (1.00) SYK
SCHEMBL17005759 0.78 SYK (0.55) SYK
SCHEMBL3282591 0.75 AKR1C3 (0.53) HDAC1RORC
SCHEMBL18351855 0.73 SYK (0.63) SYK
SCHEMBL17005763 0.73 SYK (0.63) SYK
SCHEMBL6393137 0.73 TSHR (0.49) SYKHDAC1RORC
SCHEMBL17005748 0.72 SYK (0.61) SYK
SCHEMBL17005803 0.71 SYK (0.63) SYK

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-9533989-B2 Substituted pyrimidine-5-carboxamides as spleen tyrosine kinase inhibitors Ziarco Pharma Ltd. (GB) 2017-01-03 US disclosed
US-20150232470-A1 2-(-Aminocyclohexyl)Amino-Pyrimidine-5-Carboxamides as Spleen Tyrosine Kinasei(SYK) Inhibitors PFIZER LIMITED (GB) 2015-08-20 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-20150232470-A1 2-(-Aminocyclohexyl)Amino-Pyrimidine-5-Carboxamides as Spleen Tyrosine Kinasei(SYK) Inhibitors SYK, BTK, LCK SYK 1/4885OPRK1 2013/4885OPRM1 3934/4885

“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.