SCHEMBL407318

SCHEMBL407318

c1ccc(-c2nc(C3CCNCC3)no2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 2/20 0.74
POLB P06746 2/20 0.72
CASP3 P42574 1/20 0.72
SENP7 Q9BQF6 1/20 0.72
SENP6 Q9GZR1 1/20 0.72
NPC1 O15118 3/20 0.52
RAB9A P51151 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
CHRM1 P11229 1/20 0.49
CHRM3 P20309 1/20 0.49
NR1H4 Q96RI1 2/20 0.47
USP30 Q70CQ3 2/20 0.46
SLC18A3 Q16572 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
HTT P42858 1/20 0.44
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43

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
Hydrochloric Acid SCHEMBL441062 0.98 USP7 (0.72) USP7POLBCASP3SENP7SENP6
SCHEMBL13135840 0.97 USP7 (0.74) USP7POLBCASP3SENP7SENP6
SCHEMBL10619580 0.85 USP7 (0.74) USP7POLBCASP3SENP7SENP6
SCHEMBL10040533 0.85 USP7 (0.74) USP7POLBCASP3SENP7SENP6
SCHEMBL14305118 0.84 POLB (1.00) USP7POLBCASP3SENP7SENP6
SCHEMBL3128709 0.83 POLB (0.74) USP7POLBCASP3SENP7SENP6
Hydrochloric Acid SCHEMBL4236449 0.81 POLB (0.68) USP7POLBCASP3SENP7SENP6
SCHEMBL1428566 0.80 USP7 (0.56) USP7POLBCASP3SENP7SENP6
SCHEMBL30609992 0.79 USP7 (0.58) USP7POLBCASP3SENP7SENP6
SCHEMBL26187258 0.79 USP7 (0.58) USP7POLBCASP3SENP7SENP6

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-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 US disclosed
WO-2010022055-A2 INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS AMGEN INC. (US) 2010-02-25 WO disclosed
WO-2010022055-A2 INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS AMGEN INC. (US) 2010-02-25 WO 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-20120065196-A1 AMIDE COMPOUNDS DGAT2, DGAT1, DLAT USP7 4471/4885POLB 2752/4885CASP3 3645/4885

“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.