SCHEMBL3345890

SCHEMBL3345890

CCc1[c]cc2c(c1)cc(C(N)=O)n2CCO

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.33
HSD17B10 Q99714 1/20 0.32
GPR35 Q9HC97 1/20 0.31
CCR2 P41597 1/20 0.31
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
TYK2 P29597 1/20 0.31
JAK3 P52333 1/20 0.31
PLA2G10 O15496 1/20 0.30
CNR2 P34972 1/20 0.30
F10 P00742 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
SCHEMBL3342270 0.84 HSD17B10 (0.36) MCL1HSD17B10GPR35CCR2JAK2
SCHEMBL3345892 0.70 ICMT (0.39) CNR2
SCHEMBL1744851 0.68 ACACB (0.35) MCL1
SCHEMBL26597106 0.66 POLB (0.52) CCR2
SCHEMBL3345732 0.65 BRD4 (0.34)
SCHEMBL3342600 0.65 MCL1 (0.36) MCL1
SCHEMBL3339358 0.64 GPR35 (0.39) MCL1HSD17B10GPR35
SCHEMBL27695373 0.62 CNR2 (0.62) MCL1CCR2PLA2G10CNR2F10
SCHEMBL3341415 0.61 GAA (0.33) HSD17B10
SCHEMBL1744668 0.60 CTNNB1 (0.34)

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
US-8372865-B2 Dihydropyridone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-02-12 US claimed
US-8372865-B2 Dihydropyridone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-02-12 US disclosed
US-20100160373-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS ROCHE PALO ALTO LLC 2010-06-24 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-20100160373-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS P2RY1, P2RX3, P2RX1 MCL1 2482/4885HSD17B10 4507/4885GPR35 139/4885

“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.