SCHEMBL3346937

SCHEMBL3346937

Cc1ccc(-c2cc(C3CC3)[nH]n2)cc1N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 3/20 0.51
MKNK2 Q9HBH9 3/20 0.51
DRD4 P21917 5/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
HCAR3 P49019 1/20 0.43
HCAR2 Q8TDS4 1/20 0.43
DRD2 P14416 4/20 0.43
DRD3 P35462 4/20 0.43
POLB P06746 1/20 0.43
LMNA P02545 3/20 0.43
HTT P42858 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
S1PR2 O95136 1/20 0.43
MAPT P10636 1/20 0.43
ALOX12 P18054 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TSHR P16473 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL3346932 0.81 USP30 (0.47) MKNK1MKNK2DRD4MEN1KMT2A
SCHEMBL25431152 0.80 MKNK1 (0.59) MKNK1MKNK2DRD4MEN1KMT2A
SCHEMBL14985498 0.79 MKNK1 (0.56) MKNK1MKNK2DRD4MEN1KMT2A
SCHEMBL3342198 0.78 NPC1 (0.56) HCAR2LMNASMN1; SMN2MAPTTSHR
SCHEMBL27421814 0.76 MEN1 (0.54) MKNK1MKNK2DRD4MEN1KMT2A
SCHEMBL14985535 0.73 MKNK1 (0.52) MKNK1MKNK2DRD4MEN1KMT2A
SCHEMBL19806143 0.73 MKNK1 (0.82) MKNK1MKNK2DRD4MEN1KMT2A
SCHEMBL19805568 0.73 DRD4 (0.76) MKNK1MKNK2DRD4MEN1KMT2A
SCHEMBL2374222 0.73 DRD4 (0.67) MKNK1MKNK2DRD4MEN1KMT2A
SCHEMBL3342353 0.72 HPGD (0.47) MEN1KMT2APOLBLMNASMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20100160384-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS P2RY1, P2RX6, P2RX3 MKNK1 2405/4885MKNK2 2356/4885DRD4 678/4885

“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.