SCHEMBL3013877

SCHEMBL3013877

Cc1cc(C)c(S(=O)(=O)C2CCN(c3nc(-c4c(C)cccc4C)cs3)CC2)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 11/20 0.44
RAB9A P51151 7/20 0.44
NPC1 O15118 6/20 0.44
AR P10275 2/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL3007207 0.93 SMN1; SMN2 (0.42) SMN1; SMN2RAB9ANPC1ARKMT2A
SCHEMBL3011606 0.89 SMN1; SMN2 (0.43) SMN1; SMN2RAB9ANPC1ARKMT2A
SCHEMBL3019578 0.89 AR (0.48) SMN1; SMN2RAB9ANPC1ARKMT2A
SCHEMBL3017803 0.89 AR (0.44) SMN1; SMN2RAB9ANPC1ARKMT2A
SCHEMBL3013518 0.88 AR (0.47) SMN1; SMN2RAB9ANPC1ARKMT2A
SCHEMBL3016731 0.88 SMN1; SMN2 (0.48) SMN1; SMN2RAB9ANPC1ARKMT2A
SCHEMBL3017654 0.87 AR (0.44) SMN1; SMN2RAB9ANPC1ARKMT2A
SCHEMBL3012627 0.87 MAPK1 (0.56) SMN1; SMN2RAB9ANPC1ARKMT2A
SCHEMBL3007672 0.87 AR (0.51) SMN1; SMN2RAB9ANPC1ARKMT2A
SCHEMBL3003513 0.86 SMN1; SMN2 (0.40) SMN1; SMN2RAB9ANPC1ARKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8722681-B2 N-sulfonyl thiazolylpiperazine derivatives and related N-sulfonyl heterocyclic derivatives for the treatment of neuro degenerative diseases NV REMYND (BE) 2014-05-13 US disclosed
US-20100197703-A1 N-SULFONYL THIAZOLYLPIPERAZINE DERIVATIVES AND RELATED N-SULFONYL HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES NV REMYND (BE) 2010-08-05 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-20100197703-A1 N-SULFONYL THIAZOLYLPIPERAZINE DERIVATIVES AND RELATED N-SULFONYL HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES SMN1; SMN2, HTT, SNCA SMN1; SMN2 1/4885RAB9A 2943/4885NPC1 15/4885

“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.