SCHEMBL3014489

SCHEMBL3014489

CCCc1ccc(-c2csc(N3CCC(S(=O)(=O)c4ccc(OC(F)(F)F)cc4)CC3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNQ1 P51787 1/20 0.45
SMN1; SMN2 Q16637 8/20 0.44
RAB9A P51151 6/20 0.44
MAPT P10636 5/20 0.42
ALDH1A1 P00352 4/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
MAPK1 P28482 4/20 0.42
LMNA P02545 4/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 5/20 0.40
AVPR1B P47901 1/20 0.40
HTT P42858 2/20 0.40
NPSR1 Q6W5P4 2/20 0.39
CYP1A2 P05177 1/20 0.39
POLB P06746 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
TSHR P16473 1/20 0.38

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
SCHEMBL3015872 0.94 SMN1; SMN2 (0.46) SMN1; SMN2RAB9AMAPTALDH1A1L3MBTL1
SCHEMBL3005781 0.90 SMN1; SMN2 (0.45) SMN1; SMN2RAB9AMAPTALDH1A1L3MBTL1
SCHEMBL3012932 0.89 SMN1; SMN2 (0.56) KCNQ1SMN1; SMN2RAB9AMAPTALDH1A1
SCHEMBL3015106 0.88 SMN1; SMN2 (0.52) KCNQ1SMN1; SMN2RAB9AMAPTALDH1A1
SCHEMBL3017452 0.88 RAB9A (0.56) KCNQ1SMN1; SMN2RAB9AMAPTALDH1A1
SCHEMBL3018509 0.88 AVPR1B (0.42) KCNQ1AVPR1B
SCHEMBL3009746 0.87 SMN1; SMN2 (0.56) KCNQ1SMN1; SMN2RAB9AMAPTALDH1A1
SCHEMBL3018590 0.87 ALOX5 (0.48) KCNQ1SMN1; SMN2RAB9AMAPTALDH1A1
SCHEMBL3014219 0.86 MAPT (0.49) SMN1; SMN2RAB9AMAPTALDH1A1L3MBTL1
SCHEMBL3015007 0.86 SMN1; SMN2 (0.53) KCNQ1SMN1; SMN2RAB9AMAPTALDH1A1

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 KCNQ1 2702/4885SMN1; SMN2 1/4885RAB9A 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.