SCHEMBL2962429

SCHEMBL2962429

O=S(=O)(c1ccccc1Cl)N1CCN(c2ccccc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
CHRM4 P08173 2/20 0.61
ALDH1A1 P00352 2/20 0.58
GAA P10253 1/20 0.58
HPGD P15428 1/20 0.56
CTSG P08311 1/20 0.56
CMA1 P23946 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.55
GBA1 P04062 1/20 0.55
LMNA P02545 1/20 0.54

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
SCHEMBL2953603 0.90 MAPT (0.59) MEN1KMT2ACHRM4ALDH1A1GAA
SCHEMBL2960625 0.89 TSHR (0.65) MEN1KMT2AALDH1A1GAAHPGD
SCHEMBL2962776 0.88 KMT2A (0.64) MEN1KMT2ACHRM4ALDH1A1GAA
SCHEMBL2954396 0.88 MAPT (0.57) MEN1KMT2ACHRM4ALDH1A1GAA
SCHEMBL10723724 0.88 CHRM4 (0.64) MEN1KMT2ACHRM4ALDH1A1CTSG
SCHEMBL2963614 0.86 CHRM1 (0.58) MEN1KMT2AALDH1A1GAAHPGD
SCHEMBL2954368 0.86 MEN1 (0.56) MEN1KMT2AALDH1A1GAAHPGD
SCHEMBL2957553 0.85 CHRM4 (0.53) MEN1KMT2ACHRM4ALDH1A1GAA
SCHEMBL13239834 0.85 MAPT (0.56) MEN1KMT2ACHRM4ALDH1A1GAA
SCHEMBL2961026 0.85 CHRM4 (0.62) KMT2ACHRM4ALDH1A1SMN1; SMN2GBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7759339-B2 Hydroxysteroid dehydrogenase inhibitors TAKEDA SAN DIEGO, INC. (US) 2010-07-20 US claimed
EP-1866298-A2 HYDROXYSTEROID DEHYDROGENASE INHIBITORS Takeda San Diego, Inc. (US) 2007-12-19 EP claimed
WO-2006105127-A2 HYDROXYSTEROID DEHYDROGENASE INHIBITORS TAKEDA SAN DIEGO, INC. (US) 2006-10-05 WO claimed
US-20060223829-A1 Hydroxysteroid dehydrogenase inhibitors TAKEDA SAN DIEGO, INC. 2006-10-05 US claimed
US-7759339-B2 Hydroxysteroid dehydrogenase inhibitors TAKEDA SAN DIEGO, INC. (US) 2010-07-20 US disclosed
US-7759339-B2 Hydroxysteroid dehydrogenase inhibitors TAKEDA SAN DIEGO, INC. (US) 2010-07-20 US disclosed
US-7759339-B2 Hydroxysteroid dehydrogenase inhibitors TAKEDA SAN DIEGO, INC. (US) 2010-07-20 US disclosed
EP-1866298-A2 HYDROXYSTEROID DEHYDROGENASE INHIBITORS Takeda San Diego, Inc. (US) 2007-12-19 EP disclosed
WO-2006105127-A2 HYDROXYSTEROID DEHYDROGENASE INHIBITORS TAKEDA SAN DIEGO, INC. (US) 2006-10-05 WO disclosed
US-20060223829-A1 Hydroxysteroid dehydrogenase inhibitors TAKEDA SAN DIEGO, INC. 2006-10-05 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-20060223829-A1 Hydroxysteroid dehydrogenase inhibitors HSD17B1, HSD17B3, HSD17B2 MEN1 2689/4885KMT2A 3335/4885CHRM4 4346/4885

“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.