SCHEMBL5097176

SCHEMBL5097176

CC(=O)N1CCc2cc(S(=O)(=O)n3ncc4ccc(N5CCN(C)CC5)nc43)ccc21

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.52
TNF P01375 2/20 0.49
NOD2 Q9HC29 2/20 0.49
NOD1 Q9Y239 2/20 0.49
TP53 P04637 3/20 0.48
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
HPGD P15428 1/20 0.48
MAPK1 P28482 1/20 0.48
LMNA P02545 2/20 0.45
TRIM24 O15164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 1/20 0.43
USP2 O75604 1/20 0.43

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
SCHEMBL5103514 0.84 TSHR (0.53) TSHRTNFNOD2NOD1TP53
SCHEMBL5097197 0.83 TNF (0.56) TSHRTNFNOD2NOD1TP53
SCHEMBL5097493 0.77 GBA1 (0.44) ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL3337520 0.73 TSHR (0.55) TSHRTNFNOD2NOD1TP53
SCHEMBL5097538 0.72 TNF (0.50) TNFNOD2NOD1TP53ALDH1A1
SCHEMBL5103491 0.72 HTR6 (0.61) TSHRTNFNOD2NOD1MAPK1
SCHEMBL5103528 0.72 LMNA (0.44) TSHRMEN1KMT2ALMNA
SCHEMBL4808175 0.71 NOTUM (0.67) TNFNOD2NOD1TP53ALDH1A1
SCHEMBL14140504 0.71 DRD3 (0.64) TSHRTNFNOD2NOD1TP53
Hydrochloric Acid SCHEMBL29290378 0.70 NOTUM (0.65) TNFNOD2NOD1TP53ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200471-A1 6' SUBSTITUTED COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2008-08-21 US claimed
US-20080200471-A1 6' SUBSTITUTED COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2008-08-21 US disclosed
US-20080200471-A1 6' SUBSTITUTED COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2008-08-21 US disclosed
US-20080200471-A1 6' SUBSTITUTED COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2008-08-21 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-20080200471-A1 6' SUBSTITUTED COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY HTR6, HTR1B, HTR1A TSHR 219/4885TNF 4643/4885NOD2 2893/4885

“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.