SCHEMBL14795191

SCHEMBL14795191

CC1CCCC(C)N1C(=O)c1ccc(-c2cnc3[nH]cc(C(=O)O)c3n2)s1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 15/20 0.39
JAK2 O60674 11/20 0.39
JAK1 P23458 11/20 0.39
TRPV4 Q9HBA0 1/20 0.37
SYK P43405 4/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL1372443 0.88 JAK3 (0.38) JAK3JAK2JAK1SYK
SCHEMBL1368603 0.85 JAK3 (0.57) JAK3JAK2JAK1SYK
SCHEMBL15755367 0.83 JAK3 (0.43) JAK3JAK2JAK1SYKKCNH2
SCHEMBL14795131 0.82 GRM5 (0.43) JAK3JAK2JAK1SYKKCNH2
SCHEMBL14795087 0.81 JAK3 (0.41) JAK3JAK2JAK1SYK
SCHEMBL14795159 0.80 NPC1 (0.47) JAK3SYKKCNH2
SCHEMBL15755718 0.80 JAK3 (0.41) JAK3JAK2JAK1
SCHEMBL14795228 0.80 JAK3 (0.41) JAK3JAK2JAK1
SCHEMBL14795142 0.79 JAK3 (0.40) JAK3JAK2JAK1
SCHEMBL14795327 0.79 JAK3 (0.35) JAK3JAK2JAK1SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140155376-A1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2014-06-05 US claimed
CN-103003281-A Pyrrolo [2, 3 - b] pyrazine - 7 - carboxamide derivatives and their use as jak and syk inhibitors HOFFMANN LA ROCHE 2013-03-27 CN claimed
US-20140155376-A1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2014-06-05 US disclosed
EP-2571880-A1 PYRROLO [2, 3 - B]PYRAZINE - 7 - CARBOXAMIDE DERIVATIVES AND THEIR USE AS JAK AND SYK INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2013-03-27 EP disclosed
CN-103003281-A Pyrrolo [2, 3 - b] pyrazine - 7 - carboxamide derivatives and their use as jak and syk inhibitors HOFFMANN LA ROCHE 2013-03-27 CN 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-20140155376-A1 PYRROLOPYRAZINE KINASE INHIBITORS SYK, ZAP70, JAK2 JAK3 7/4885JAK2 3/4885JAK1 5/4885

“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.