SCHEMBL875476

SCHEMBL875476

Nc1c(C2CC2)nc2c(C(F)(F)F)cccn2c1=O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 1/20 0.44
RORC P51449 1/20 0.38
BRD4 O60885 1/20 0.35
XPO1 O14980 1/20 0.35
CCR2 P41597 1/20 0.35
NR1H3 Q13133 9/20 0.34
NR1H2 P55055 7/20 0.33
AADAT Q8N5Z0 1/20 0.33
CBLB Q13191 1/20 0.32
MCHR1 Q99705 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
TRPA1 O75762 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
SCHEMBL875617 0.82 USP7 (0.36) USP7RORCBRD4XPO1NR1H3
SCHEMBL876238 0.81 MCHR1 (0.39) CCR2MCHR1
SCHEMBL15766422 0.80 USP7 (0.41) USP7RORCBRD4XPO1NR1H3
SCHEMBL14685164 0.80 BRD4 (0.42) USP7RORCBRD4XPO1NR1H3
SCHEMBL875250 0.77 RORC (0.38) USP7RORCBRD4CCR2TP53
SCHEMBL883428 0.75 SMN1; SMN2 (0.40) RORCBRD4XPO1TP53MAPT
SCHEMBL875672 0.75 PIK3CD (0.47) USP7BRD4NR1H3NR1H2TRPA1
SCHEMBL28659586 0.70 KDM4E (0.59) USP7
SCHEMBL26134584 0.66 CHRM4 (0.43) BRD4NR1H3NR1H2TP53RXFP1
SCHEMBL26644719 0.66 ALDH1A1 (0.45) NR1H3NR1H2MAPT

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-2619202-A1 PYRIDMIDONES FOR TREATMENT OF POTASSIUM CHANNEL RELATED DISEASES Pfizer Inc (US) 2013-07-31 EP disclosed
US-20130184294-A1 Pyrimidones for Treatment of Potassium Channel Related Diseases PFIZER INC. (US) 2013-07-18 US disclosed
WO-2012038850-A1 PYRIDMIDONES FOR TREATMENT OF POTASSIUM CHANNEL RELATED DISEASES PFIZER INC. (US) 2012-03-29 WO 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-20130184294-A1 Pyrimidones for Treatment of Potassium Channel Related Diseases KCNQ5, KCNQ1, KCNQ3 USP7 4875/4885RORC 315/4885BRD4 891/4885

“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.