SCHEMBL7614726

SCHEMBL7614726

CC(C)(C)OC(=O)N1CCc2[nH]c3ccc(S(=O)(=O)c4ccccc4)cc3c2CC1.O=S(=O)(c1ccccc1)c1ccc2c(c1)[C@@H]1CCNCC[C@H]1N2

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 5/20 0.43
▸ SFRP1 Q8N474 4/20 0.38
▸ BAZ2B Q9UIF8 3/20 0.37
▸ MAPT P10636 3/20 0.37
▸ CFTR P13569 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ GPR119 Q8TDV5 1/20 0.34
▸ PIK3CA P42336 1/20 0.34

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
SCHEMBL7614729 1.00 HTR6 (0.43) HTR6SFRP1BAZ2BMAPTCFTR
SCHEMBL7614732 1.00 HTR6 (0.43) HTR6SFRP1BAZ2BMAPTCFTR
SCHEMBL6196157 0.85 HTR6 (0.53) HTR6SFRP1BAZ2BMAPTCFTR
SCHEMBL6201924 0.81 SFRP1 (0.49) SFRP1GPR119PIK3CA
SCHEMBL6201926 0.81 SFRP1 (0.49) SFRP1GPR119PIK3CA
SCHEMBL6200793 0.74 HTR6 (0.50) HTR6SFRP1
SCHEMBL6200791 0.74 HTR6 (0.50) HTR6SFRP1
SCHEMBL6200798 0.74 HTR6 (0.50) HTR6SFRP1
SCHEMBL6200573 0.72 HTR6 (0.57) HTR6BAZ2BMAPT
SCHEMBL6038224 0.70 HTR6 (0.54) HTR6BAZ2BMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020160999-A1 Substituted indolines PHARMACIA & UPJOHN COMPANY 2002-10-31 — — 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-20020160999-A1 Substituted indolines TPH1, TPH2, NLN HTR6 16/4885SFRP1 4249/4885BAZ2B 3542/4885

“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.

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