SCHEMBL13840440

SCHEMBL13840440

CCS(=O)(=O)N[C@H]1CC[C@H](C(=O)Nc2ccc3c(OC)c(C(=O)NC(C)C)oc3c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.43
▸ MEN1 O00255 5/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ HTT P42858 3/20 0.43
▸ GAA P10253 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ ALDH1A1 P00352 5/20 0.42
▸ KDM4E B2RXH2 4/20 0.42
▸ NPSR1 Q6W5P4 3/20 0.41
▸ JAK1 P23458 1/20 0.40
▸ HSD17B10 Q99714 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ DHODH Q02127 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ TP53 P04637 2/20 0.38
▸ POLB P06746 1/20 0.37

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
SCHEMBL13840444 0.93 KMT2A (0.43) KMT2AMEN1SMN1; SMN2HTTGAA
SCHEMBL13840452 0.90 MEN1 (0.47) KMT2AMEN1SMN1; SMN2HTTGAA
SCHEMBL13840446 0.83 MEN1 (0.44) KMT2AMEN1SMN1; SMN2HTTGAA
SCHEMBL10114635 0.68 KDM4E (0.69) KMT2AMEN1SMN1; SMN2HTTGAA
SCHEMBL10113951 0.68 KDM4E (0.69) KMT2AMEN1SMN1; SMN2HTTGAA
SCHEMBL13840441 0.67 HSD17B10 (0.50) KMT2AMEN1SMN1; SMN2HTTGAA
SCHEMBL13840445 0.67 GNRHR (0.45) KMT2AMEN1GAANPSR1JAK1
SCHEMBL10114287 0.67 SMN1; SMN2 (0.60) KMT2AMEN1SMN1; SMN2HTTGAA
SCHEMBL13840439 0.67 KDM4E (0.59) KMT2AMEN1SMN1; SMN2HTTGAA
SCHEMBL14424365 0.66 POLB (0.48) KMT2ASMN1; SMN2HTTGAALMNA

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-7534892-B2 Sulfonamide compound SHIONOGI & CO., LTD. (JP) 2009-05-19 — — US disclosed
US-20070287710-A1 Piperidinediyl-containing sulfonamide; NPY Y5 receptor antagonist activity; antiobesity agent or anorectic agent SHIONOGI & CO., LTD. (JP) 2007-12-13 — — 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-20070287710-A1 Piperidinediyl-containing sulfonamide; NPY Y5 receptor antagonist activity; antiobesity agent or anorectic agent NPY5R, NPY1R, NPY2R KMT2A 1321/4885MEN1 2970/4885SMN1; SMN2 2915/4885

“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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