SCHEMBL14737353

SCHEMBL14737353

CCCC[Sn](CCCC)(CCCC)c1nn(C)c2ccc(OC(F)F)cc12

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.36
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32
BACE1 P56817 2/20 0.32
HTR3A P46098 2/20 0.32
MCHR1 Q99705 1/20 0.32
LSS P48449 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.31
SCN9A Q15858 1/20 0.30
CACNA1H O95180 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30

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
SCHEMBL14738036 0.86 ELANE (0.39) KDM4EALDH1A1
SCHEMBL14738334 0.85 MAOA (0.42) KDM4EHSD17B10HTR3AMCHR1ALDH1A1
SCHEMBL14737876 0.83 SYK (0.45) SYKKDM4EHSD17B10MCHR1
SCHEMBL14737317 0.79 CA12 (0.33) LSS
SCHEMBL14737566 0.78 SYK (0.34) SYK
SCHEMBL14738293 0.78 RORA (0.43)
SCHEMBL14737230 0.77 CYP1A2 (0.38) ALDH1A1
SCHEMBL14737562 0.77 MAPK8 (0.42)
SCHEMBL14737223 0.77 RORA (0.41) KDM4EALDH1A1
SCHEMBL14737955 0.76 ALDH1A1 (0.36) KDM4EALDH1A1SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2763990-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2017-02-22 EP disclosed
CN-104024258-A Pyrrolopyrazine kinase inhibitors HOFFMANN LA ROCHE 2014-09-03 CN disclosed
EP-2763990-A1 PYRROLOPYRAZINE KINASE INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2014-08-13 EP disclosed
US-8658646-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LAROCHE INC. (US) 2014-02-25 US disclosed
WO-2013030138-A1 PYRROLOPYRAZINE KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2013-03-07 WO disclosed
US-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN-LA ROCHE INC. 2013-03-07 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-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS SYK, ZAP70, JAK1 SYK 1/4885KDM4E 718/4885HSD17B10 3538/4885

“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.