SCHEMBL6739732

SCHEMBL6739732

C[C@@H](C[CH]C(=O)NC1CCN(S(=O)(=O)c2cc(Cl)c(OC3CCNCC3)c(Cl)c2)CC1)C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 8/20 0.46
NPC1 O15118 1/20 0.37
TGM2 P21980 6/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
POLB P06746 2/20 0.36
LMNA P02545 1/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
TGM6 O95932 1/20 0.34
F13A1 P00488 1/20 0.34
TGM1 P22735 1/20 0.34
PKM P14618 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
SCHEMBL6741196 0.96 UTS2R (0.48) UTS2RNPC1TGM2SMN1; SMN2POLB
SCHEMBL6093947 0.86 SMN1; SMN2 (0.44) UTS2RTGM2SMN1; SMN2POLBLMNA
SCHEMBL6741280 0.86 UTS2R (0.55) UTS2RNPC1SMN1; SMN2POLBLMNA
SCHEMBL6093542 0.85 UTS2R (0.37) UTS2RTGM2SMN1; SMN2GAAKMT2A
SCHEMBL6739733 0.82 UTS2R (0.47) UTS2RNPC1SMN1; SMN2POLBLMNA
SCHEMBL6741880 0.82 UTS2R (0.44) UTS2RTGM2SMN1; SMN2POLBLMNA
SCHEMBL6744733 0.82 UTS2R (0.44) UTS2RTGM2SMN1; SMN2POLBLMNA
SCHEMBL6744780 0.80 UTS2R (0.61) UTS2R
SCHEMBL6742625 0.80 UTS2R (0.61) UTS2R
SCHEMBL6741197 0.78 UTS2R (0.52) UTS2RNPC1SMN1; SMN2POLB

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-20040152692-A1 Urotensin antagonist; therapy for congestive heart failure; antiischemic agents; cardiovascular disorders; strokes; hypotensive agents; respiratory system disorders; restenosis; antiinflammatory agents; psychological disorders SMITHKLINE BEECHAM CORPORATION 2004-08-05 US claimed
US-20040152692-A1 Urotensin antagonist; therapy for congestive heart failure; antiischemic agents; cardiovascular disorders; strokes; hypotensive agents; respiratory system disorders; restenosis; antiinflammatory agents; psychological disorders SMITHKLINE BEECHAM CORPORATION 2004-08-05 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-20040152692-A1 Urotensin antagonist; therapy for congestive heart failure; antiischemic agents; cardiovascular disorders; strokes; hypotensive agents; respiratory system disorders; restenosis; antiinflammatory agents; psychological disorders UTS2R, PLAUR, SERPINE1 UTS2R 1/4885NPC1 4334/4885TGM2 730/4885

“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.