SCHEMBL14737223

SCHEMBL14737223

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

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RORA P35398 4/20 0.41
RORC P51449 4/20 0.41
RORB Q92753 4/20 0.41
CNR1 P21554 2/20 0.36
CNR2 P34972 2/20 0.36
KCNA3 P22001 1/20 0.36
CCR2 P41597 7/20 0.35
KCNH2 Q12809 7/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PGR P06401 4/20 0.34
KIF11 P52732 1/20 0.34
HRH1 P35367 1/20 0.34
HTR6 P50406 1/20 0.34

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
SCHEMBL14738530 0.90 KIF11 (0.40) RORARORCRORBCNR1CNR2
SCHEMBL14738036 0.81 ELANE (0.39) RORARORCRORBKDM4EALDH1A1
SCHEMBL14737604 0.80 PGR (0.32) RORARORCRORBPGR
SCHEMBL14737562 0.80 MAPK8 (0.42)
SCHEMBL14737966 0.78 RORA (0.39) RORARORCRORBPGR
SCHEMBL14738293 0.78 RORA (0.43) RORARORCRORBCNR1CNR2
SCHEMBL14738334 0.78 MAOA (0.42) RORARORCRORBKDM4EALDH1A1
SCHEMBL14737733 0.77 DRD2 (0.39) HRH1HTR6
SCHEMBL14737353 0.77 SYK (0.36) KDM4EALDH1A1
SCHEMBL14737720 0.76 PGR (0.39) RORARORCRORBCNR1CNR2

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 4 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
US-8658646-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LAROCHE INC. (US) 2014-02-25 US 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 RORA 1952/4885RORC 680/4885RORB 1284/4885

“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.