SCHEMBL10293175

SCHEMBL10293175

CCNC(=O)c1cc2cc(S(=O)(=O)N3CC(C)CC(C)C3)ccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.47
CNR1 P21554 3/20 0.46
CNR2 P34972 3/20 0.46
ALDH1A1 P00352 3/20 0.44
NR2F2 P24468 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALOX15 P16050 1/20 0.44
GHSR Q92847 4/20 0.44
RAB9A P51151 1/20 0.43
MAPT P10636 1/20 0.43
POLB P06746 1/20 0.43
GAA P10253 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
SCHEMBL8275504 0.88 MEN1 (0.45) NAMPTCNR1CNR2ALDH1A1NR2F2
SCHEMBL10293240 0.88 MEN1 (0.58) NAMPTALDH1A1RAB9AMAPTPOLB
SCHEMBL10293155 0.87 CNR1 (0.59) NAMPTCNR1CNR2ALDH1A1MAPT
SCHEMBL10293115 0.86 CNR1 (0.60) NAMPTCNR1CNR2GHSRRAB9A
SCHEMBL10293150 0.85 CNR1 (0.52) CNR1CNR2GHSR
SCHEMBL8278394 0.85 CNR1 (0.47) CNR1CNR2ALDH1A1SMN1; SMN2ALOX15
SCHEMBL10293171 0.85 SYK (0.48) NAMPTCNR1CNR2ALDH1A1GHSR
SCHEMBL1156443 0.85 HPGD (0.51) CNR1CNR2ALDH1A1NR2F2SMN1; SMN2
SCHEMBL1156330 0.84 NR2F2 (0.56) CNR1CNR2ALDH1A1NR2F2MAPT
SCHEMBL10293246 0.84 CNR1 (0.54) NAMPTCNR1CNR2GHSRRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8211935-B2 Heterocyclic derivatives for modulation of calcium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-07-03 US disclosed
US-20110178061-A1 HETEROCYCLIC DERIVATIVES FOR MODULATION OF CALCIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-07-21 US disclosed
US-7888384-B2 Heterocyclic derivatives for modulation of calcium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-02-15 US disclosed
US-7888384-B2 Heterocyclic derivatives for modulation of calcium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-02-15 US disclosed
US-20090253682-A1 HETEROCYCLIC DERIVATIVES FOR MODULATION OF CALCIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED 2009-10-08 US disclosed
US-20090253682-A1 HETEROCYCLIC DERIVATIVES FOR MODULATION OF CALCIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED 2009-10-08 US disclosed
US-7569604-B2 Heterocyclic derivatives for modulation of calcium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-08-04 US disclosed
US-7569604-B2 Heterocyclic derivatives for modulation of calcium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-08-04 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-20090253682-A1 HETEROCYCLIC DERIVATIVES FOR MODULATION OF CALCIUM CHANNELS CACNA1D, ORAI1, CACNA1C NAMPT 2751/4885CNR1 180/4885CNR2 162/4885
US-20110178061-A1 HETEROCYCLIC DERIVATIVES FOR MODULATION OF CALCIUM CHANNELS CACNA1D, ORAI1, CACNA1C NAMPT 2751/4885CNR1 180/4885CNR2 162/4885

“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.