SCHEMBL3485705

SCHEMBL3485705

Cc1cccc(NC(=O)CN2CCC(N(C(C)C)S(=O)(=O)c3cccc(C(F)(F)F)c3)CC2)c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
LMNA P02545 3/20 0.54
HSD17B10 Q99714 1/20 0.54
MAPT P10636 3/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
DRD4 P21917 10/20 0.52
DRD2 P14416 4/20 0.52
DRD3 P35462 3/20 0.52
TSHR P16473 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
TP53 P04637 1/20 0.49
UBE2M P61081 1/20 0.49
DCUN1D1 Q96GG9 1/20 0.49
KDM4E B2RXH2 1/20 0.48
POLB P06746 1/20 0.48

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
SCHEMBL3485824 0.93 ALDH1A1 (0.52) ALDH1A1LMNAHSD17B10MAPTSMN1; SMN2
SCHEMBL13541697 0.92 ALDH1A1 (0.60) ALDH1A1DRD4DRD2DRD3
SCHEMBL3485918 0.89 TSHR (0.56) ALDH1A1LMNAHSD17B10MAPTSMN1; SMN2
SCHEMBL3485688 0.88 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10MAPTSMN1; SMN2
SCHEMBL3485265 0.88 ALDH1A1 (0.47) ALDH1A1LMNAHSD17B10MAPTSMN1; SMN2
SCHEMBL3485300 0.86 SMN1; SMN2 (0.52) ALDH1A1LMNAHSD17B10MAPTSMN1; SMN2
SCHEMBL13541694 0.86 DRD4 (0.53) ALDH1A1LMNAMAPTDRD4DRD2
SCHEMBL3486183 0.86 LMNA (0.48) ALDH1A1LMNAHSD17B10MAPTSMN1; SMN2
SCHEMBL3484989 0.86 RORC (0.55) ALDH1A1LMNAHSD17B10MAPTSMN1; SMN2
SCHEMBL3485926 0.86 CACNA1B (0.53) ALDH1A1LMNAHSD17B10MAPTSMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8791264-B2 Benzenesulfonamide compounds and their use as blockers of calcium channels PURDUE PHARMA L.P. (US) 2014-07-29 US claimed
US-20100022595-A1 Benzenesulfonamide Compounds and Their Use as Blockers of Calcium Channels PURDUE PHARMA L.P. (CT) 2010-01-28 US claimed
WO-2007118853-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS BLOCKERS OF CALCIUM CHANNELS EURO-CELTIQUE S.A. (LU) 2007-10-25 WO claimed
US-8791264-B2 Benzenesulfonamide compounds and their use as blockers of calcium channels PURDUE PHARMA L.P. (US) 2014-07-29 US disclosed
US-20100022595-A1 Benzenesulfonamide Compounds and Their Use as Blockers of Calcium Channels PURDUE PHARMA L.P. (CT) 2010-01-28 US disclosed
WO-2007118853-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS BLOCKERS OF CALCIUM CHANNELS EURO-CELTIQUE S.A. (LU) 2007-10-25 WO disclosed
WO-2007118853-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS BLOCKERS OF CALCIUM CHANNELS EURO-CELTIQUE S.A. (LU) 2007-10-25 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-20100022595-A1 Benzenesulfonamide Compounds and Their Use as Blockers of Calcium Channels CACNA1A, CACNA1E, CACNA1B ALDH1A1 2210/4885LMNA 1608/4885HSD17B10 4401/4885

“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.