SCHEMBL3018169

SCHEMBL3018169

Cc1ccc(Cc2csc(N3CCN(S(=O)(=O)c4ccc(CBr)cc4)CC3)n2)cc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 3/20 0.41
USP2 O75604 2/20 0.41
PKM P14618 2/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPSR1 Q6W5P4 2/20 0.40
HTT P42858 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
KDM4E B2RXH2 2/20 0.39
TSHR P16473 1/20 0.38
YAP1 P46937 1/20 0.38
TEAD4 Q15561 1/20 0.38
MAPK1 P28482 1/20 0.38
LPAR1 Q92633 1/20 0.37
LPAR2 Q9HBW0 1/20 0.37

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
SCHEMBL3004879 0.92 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3017192 0.92 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3017538 0.90 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3017242 0.90 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3009797 0.89 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3015956 0.89 SMN1; SMN2 (0.47) ALDH1A1SMN1; SMN2L3MBTL1USP2PKM
SCHEMBL3009417 0.89 MAPT (0.44) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2
SCHEMBL3003265 0.89 HSD11B1 (0.47) ALDH1A1SMN1; SMN2L3MBTL1LMNAMEN1
SCHEMBL3013249 0.88 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2L3MBTL1MAPTLMNA
SCHEMBL3007289 0.88 SMN1; SMN2 (0.42) ALDH1A1SMN1; SMN2L3MBTL1MAPTUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2188272-B1 PHENYL- AND BENZYLTHIAZOLYLPIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES REMYND NV (BE) 2016-02-24 EP disclosed
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
EP-2188272-A2 PHENYL- AND BENZYLTHIAZOLYLPIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV Remynd (BE) 2010-05-26 EP disclosed
WO-2009019295-A2 PHENYL- AND BENZYLTHIAZOLYLPIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-02-12 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-20100197703-A1 N-SULFONYL THIAZOLYLPIPERAZINE DERIVATIVES AND RELATED N-SULFONYL HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES SMN1; SMN2, HTT, SNCA ALDH1A1 3510/4885SMN1; SMN2 1/4885L3MBTL1 1847/4885

“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.