SCHEMBL178537

SCHEMBL178537

Cc1ccc(NCC2CCN(C)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.50
PRMT6 Q96LA8 1/20 0.50
AXL P30530 1/20 0.45
ACHE P22303 3/20 0.45
BACE1 P56817 2/20 0.45
MAPT P10636 1/20 0.44
KDM1A O60341 1/20 0.43
MAOB P27338 1/20 0.43
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
USP30 Q70CQ3 1/20 0.41
POLB P06746 1/20 0.40
USP1 O94782 1/20 0.40
WDR48 Q8TAF3 1/20 0.40
NAMPT P43490 1/20 0.40
SCN1A P35498 1/20 0.40
SCN2A Q99250 1/20 0.40
SCN3A Q9NY46 1/20 0.40

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
SCHEMBL22299880 0.83 NPC1 (0.52) CARM1PRMT6ACHEBACE1MAPT
SCHEMBL104979 0.82 CARM1 (0.47) CARM1PRMT6AXLACHEBACE1
SCHEMBL2056107 0.81 HTR2A (0.48) CARM1PRMT6AXLACHEBACE1
SCHEMBL10980087 0.80 NPC1 (0.51) MAPTPOLB
SCHEMBL13676299 0.79 GAA (0.51) CARM1PRMT6MAPTPOLB
SCHEMBL21256814 0.78 MAPT (0.42) CARM1PRMT6ACHEBACE1MAPT
SCHEMBL2056212 0.77 HTR2A (0.50) CARM1PRMT6ACHEBACE1HTR2A
SCHEMBL12670063 0.77 NAMPT (0.47) CARM1PRMT6AXLACHEBACE1
SCHEMBL21534968 0.77 CARM1 (0.49) CARM1PRMT6ACHEBACE1USP30
SCHEMBL21256816 0.77 KCNH3 (0.47) CARM1PRMT6MAPT

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-20120059162-A1 FUSED IMIDAZOLE DERIVATIVE HAVING TTK INHIBITORY ACTION ONCOTHERAPY SCIENCE, INC. (JP) 2012-03-08 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-20120059162-A1 FUSED IMIDAZOLE DERIVATIVE HAVING TTK INHIBITORY ACTION NR0B1, GRK7, NR5A2 CARM1 1278/4885PRMT6 784/4885AXL 3101/4885

“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.