SCHEMBL3343307

SCHEMBL3343307

CCc1[c]cc2ccc(C(N)=O)nc2c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.38
GRM2 Q14416 12/20 0.36
PIM1 P11309 1/20 0.36
FAAH O00519 1/20 0.35
PARP1 P09874 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
KDM4E B2RXH2 1/20 0.32
NNMT P40261 1/20 0.32
LMNA P02545 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
SCHEMBL3344557 0.80 GRM2 (0.41) PTPN1GRM2PIM1FAAHALDH1A1
SCHEMBL12505386 0.77 NNMT (0.41) PTPN1GRM2PIM1FAAHALDH1A1
SCHEMBL5623414 0.73 GRM2 (0.56) PTPN1GRM2PIM1FAAHALDH1A1
SCHEMBL16146821 0.71 CHEK2 (0.36) PTPN1GRM2PIM1FAAHPARP1
SCHEMBL16146298 0.71 PTPN1 (0.34) PTPN1GRM2PIM1FAAH
SCHEMBL20921201 0.71 MEN1 (0.46) PTPN1PARP1ALDH1A1GAALMNA
SCHEMBL3342006 0.71 PTPN1 (0.43) PTPN1GRM2PIM1FAAHNNMT
SCHEMBL16146559 0.71 ADA (0.38) PTPN1GRM2FAAH
SCHEMBL16146888 0.71 FAAH (0.32) PTPN1GRM2FAAH
SCHEMBL16146674 0.70 ALDH1A1 (0.42) PTPN1GRM2FAAHPARP1ALDH1A1

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 5 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
EP-2393781-B1 DIHYDROPYRIDONE UREAS AS P2X7 MODULATORS HOFFMANN LA ROCHE (CH) 2014-03-12 EP disclosed
US-8372865-B2 Dihydropyridone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-02-12 US disclosed
US-20100160388-A1 DIHYDROPYRIDONE UREAS AS P2X7 MODULATORS ROCHE PALO ALTO LLC 2010-06-24 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 (2 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-20100160388-A1 DIHYDROPYRIDONE UREAS AS P2X7 MODULATORS P2RY1, P2RX1, P2RX3 PTPN1 1428/4885GRM2 496/4885PIM1 3936/4885
US-20100160373-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS P2RY1, P2RX3, P2RX1 PTPN1 910/4885GRM2 337/4885PIM1 3873/4885

“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.