SCHEMBL14738313

SCHEMBL14738313

Cc1ccc2c(-c3cnc4c(n3)c(C(=O)NC(C)(C)CO[Si](C)(C)C(C)(C)C)cn4C(c3ccccc3)(c3ccccc3)c3ccccc3)nn(CCN3CCOCC3)c2c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SYK P43405 9/20 0.43
KCNH2 Q12809 2/20 0.41
CYP2C9 P11712 1/20 0.41
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
TYK2 P29597 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
CREBBP Q92793 1/20 0.33
KDM5B Q9UGL1 1/20 0.32
CYP2D6 P10635 2/20 0.32
MAPK14 Q16539 1/20 0.32
NR3C1 P04150 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32

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
SCHEMBL14737250 0.97 SYK (0.45) SYKKCNH2CYP2C9CYP2D6NR3C1
SCHEMBL14738280 0.92 SYK (0.39) SYKKCNH2CYP2C9MAPT
SCHEMBL14752781 0.91 SYK (0.47) SYKKCNH2CYP2C9TYK2CYP2D6
SCHEMBL14751493 0.90 SYK (0.44) SYKKCNH2CYP2C9CNR1CNR2
SCHEMBL14752762 0.88 SYK (0.49) SYKKCNH2CYP2C9CYP2D6NR3C1
SCHEMBL14751553 0.87 SYK (0.46) SYKKCNH2CYP2C9CYP2D6NR3C1
SCHEMBL14737054 0.83 SYK (0.45) SYKKCNH2CYP2C9CYP2D6
SCHEMBL14737154 0.83 SYK (0.51) SYKKCNH2CYP2C9CYP2D6
SCHEMBL14738283 0.81 SYK (0.58) SYKKCNH2CYP2C9CYP2D6
SCHEMBL14751433 0.81 SYK (0.41) SYKKCNH2CYP2C9MAPTCYP2D6

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
EP-2763990-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2017-02-22 EP 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 SYK 1/4885KCNH2 3389/4885CYP2C9 3710/4885

“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.