SCHEMBL3019012

SCHEMBL3019012

Cc1ccccc1-c1csc(N2CCC(S(=O)(=O)c3cccc(F)c3)CC2)n1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
AR P10275 6/20 0.45
GPR6 P46095 1/20 0.41
USP2 O75604 1/20 0.41
MAPT P10636 1/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 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
SCHEMBL3013809 0.93 AR (0.44) SMN1; SMN2NPC1RAB9AARGPR6
SCHEMBL3015505 0.91 AR (0.54) SMN1; SMN2NPC1RAB9AARGPR6
SCHEMBL3020255 0.90 RAB9A (0.45) SMN1; SMN2NPC1RAB9AARGPR6
SCHEMBL2998605 0.89 SMN1; SMN2 (0.48) SMN1; SMN2NPC1RAB9AARUSP2
SCHEMBL3016323 0.89 RAB9A (0.47) SMN1; SMN2NPC1RAB9AARMAPT
SCHEMBL3017311 0.89 SMN1; SMN2 (0.42) SMN1; SMN2NPC1RAB9AARMAPT
SCHEMBL3020176 0.88 AR (0.56) SMN1; SMN2NPC1RAB9AARGPR6
SCHEMBL3009743 0.88 RAF1 (0.50) SMN1; SMN2NPC1RAB9AARL3MBTL1
SCHEMBL3016015 0.86 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9AARMAPT
SCHEMBL3002435 0.86 NPC1 (0.42) SMN1; SMN2NPC1RAB9AARGPR6

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 1/4885NPC1 15/4885RAB9A 2943/4885

“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.