SCHEMBL3015872

SCHEMBL3015872

CCc1ccc(-c2csc(N3CCC(S(=O)(=O)c4ccc(OC(F)(F)F)cc4)CC3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 9/20 0.46
RAB9A P51151 7/20 0.46
MAPT P10636 5/20 0.44
ALDH1A1 P00352 4/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPK1 P28482 4/20 0.44
LMNA P02545 4/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
NPC1 O15118 6/20 0.42
HTT P42858 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
POLB P06746 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
AVPR1B P47901 1/20 0.40
TSHR P16473 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
SCHEMBL3014489 0.94 KCNQ1 (0.45) SMN1; SMN2RAB9AMAPTALDH1A1L3MBTL1
SCHEMBL3005781 0.92 SMN1; SMN2 (0.45) SMN1; SMN2RAB9AMAPTALDH1A1L3MBTL1
SCHEMBL3017452 0.91 RAB9A (0.56) SMN1; SMN2RAB9AMAPTALDH1A1L3MBTL1
SCHEMBL3015106 0.91 SMN1; SMN2 (0.52) SMN1; SMN2RAB9AMAPTALDH1A1L3MBTL1
SCHEMBL3006770 0.90 SMN1; SMN2 (0.57) SMN1; SMN2RAB9AMAPTALDH1A1L3MBTL1
SCHEMBL3018590 0.89 ALOX5 (0.48) SMN1; SMN2RAB9AMAPTALDH1A1L3MBTL1
SCHEMBL3014219 0.89 MAPT (0.49) SMN1; SMN2RAB9AMAPTALDH1A1L3MBTL1
SCHEMBL3014390 0.88 SMN1; SMN2 (0.58) SMN1; SMN2RAB9AMAPTALDH1A1L3MBTL1
SCHEMBL3000034 0.87 AVPR1B (0.42) AVPR1BTSHR
SCHEMBL3003095 0.87 SMN1; SMN2 (0.55) SMN1; SMN2RAB9AMAPTALDH1A1L3MBTL1

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 2943/4885MAPT 18/4885

“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.