SCHEMBL3346920

SCHEMBL3346920

Cc1cnn(-c2ccc(C)c(C(N)=O)c2)c(=O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 2/20 0.45
RIPK2 O43353 1/20 0.41
SIRT3 Q9NTG7 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 4/20 0.39
MAPT P10636 2/20 0.38
TSHR P16473 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALOX15 P16050 1/20 0.38
P2RX7 Q99572 1/20 0.38
NPC1 O15118 3/20 0.37
PARP1 P09874 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NNMT P40261 2/20 0.36
PKM P14618 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
HPGD P15428 1/20 0.35

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
SCHEMBL3342520 0.81 P2RX7 (0.47) RAB9ASMN1; SMN2LMNARIPK2SIRT3
SCHEMBL3343670 0.81 CA1 (0.47) RAB9ASMN1; SMN2LMNARIPK2SIRT3
SCHEMBL3346925 0.80 MAPT (0.42) RAB9ASMN1; SMN2LMNATDP1ALDH1A1
SCHEMBL3348732 0.78 P2RX7 (0.58) RAB9ASMN1; SMN2LMNASIRT3TDP1
SCHEMBL3346714 0.78 P2RX7 (0.50) RAB9ASMN1; SMN2LMNARIPK2SIRT3
SCHEMBL3346206 0.77 KAT6A (0.46) RAB9ASMN1; SMN2SIRT3TDP1ALDH1A1
SCHEMBL3347955 0.76 RAB9A (0.42) RAB9ASMN1; SMN2LMNARIPK2SIRT3
SCHEMBL3342947 0.76 ALDH1A1 (0.41) RAB9ASMN1; SMN2LMNASIRT3TDP1
SCHEMBL3342290 0.76 MAPK14 (0.38) RAB9ASMN1; SMN2LMNARIPK2SIRT3
SCHEMBL3342210 0.71 ALDH1A1 (0.49) LMNASIRT3TDP1ALDH1A1MAPT

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-8435990-B2 Dihydropyrimidone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-05-07 US disclosed
US-20110028502-A1 DIHYDROPYRIMIDONE AMIDES AS P2X7 MODULATORS BROTHERTON-PLEISS CHRISTINE E 2011-02-03 US disclosed
US-20100160384-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-20100160384-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS P2RY1, P2RX6, P2RX3 RAB9A 1850/4885SMN1; SMN2 2819/4885LMNA 2330/4885
US-20110028502-A1 DIHYDROPYRIMIDONE AMIDES AS P2X7 MODULATORS P2RY1, P2RX7, P2RX3 RAB9A 1568/4885SMN1; SMN2 3020/4885LMNA 2432/4885

“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.