SCHEMBL5630748

SCHEMBL5630748

Cc1cc(C)cc(CN2CCc3ccc(S(=O)(=O)NCCC4CCCN4C)cc3C2)c1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 6/20 0.42
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.39
OPRK1 P41145 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MOGAT2 Q3SYC2 7/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL5629084 0.90 SMN1; SMN2 (0.47) HTR7TP53TSHRALDH1A1SMN1; SMN2
SCHEMBL5632368 0.89 ATM (0.43) HTR7TP53TSHRMOGAT2SMN1; SMN2
SCHEMBL5628430 0.87 HTR7 (0.42) HTR7MOGAT2
SCHEMBL3752809 0.85 MAPT (0.47) HTR7ALDH1A1
SCHEMBL5630601 0.85 HTR7 (0.45) HTR7TP53TSHRALDH1A1
SCHEMBL5629574 0.85 MCHR1 (0.44) TP53TSHRALDH1A1SMN1; SMN2
SCHEMBL14947355 0.85 TSHR (0.45) HTR7TP53TSHRALDH1A1
SCHEMBL1241268 0.84 HRH3 (0.46) HTR7TP53TSHRALDH1A1MOGAT2
SCHEMBL2400927 0.84 HRH3 (0.46) HTR7TP53TSHRALDH1A1MOGAT2
Water SCHEMBL16161850 0.83 HRH3 (0.46) HTR7TP53TSHRALDH1A1MOGAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070105834-A1 TETRAHYDROISOQUINOLINE SULFONAMIDE DERIVATIVES, THE PREPARATION THEREOF, AND THE USE OF THE SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2007-05-10 US claimed
CN-1956962-B Tetrahydroisoquinoline sulfonamide derivatives, their preparation and their use in therapy SANOFI AVENTIS 2014-08-20 CN disclosed
US-20070105834-A1 TETRAHYDROISOQUINOLINE SULFONAMIDE DERIVATIVES, THE PREPARATION THEREOF, AND THE USE OF THE SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2007-05-10 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-20070105834-A1 TETRAHYDROISOQUINOLINE SULFONAMIDE DERIVATIVES, THE PREPARATION THEREOF, AND THE USE OF THE SAME IN THERAPEUTICS BACE1, SLC6A2, KCNQ2 HTR7 175/4885TP53 4291/4885TSHR 2053/4885

“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.