SCHEMBL14102424

SCHEMBL14102424

O=S(=O)(NC[C@@H]1CCCN1)c1ccc(F)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.51
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
ALDH1A1 P00352 3/20 0.46
PKM P14618 1/20 0.46
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
TAAR1 Q96RJ0 1/20 0.44
CA9 Q16790 1/20 0.44
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CYP19A1 P11511 1/20 0.42
TP53 P04637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL14375100 0.86 SLC12A2 (0.52) HTR6MEN1KMT2AALDH1A1CA9
SCHEMBL14102431 0.86 GBA1 (0.42) HTR6MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL4743569 0.85 GBA1 (0.59) HTR6MEN1KMT2AALDH1A1PKM
SCHEMBL19234423 0.84 HTR6 (0.45) HTR6KMT2AALDH1A1TSHRSMN1; SMN2
SCHEMBL14282764 0.81 KMT2A (0.58) HTR6MEN1KMT2AALDH1A1PKM
SCHEMBL21713911 0.78 HTR6 (0.53) HTR6KMT2APKMLMNA
SCHEMBL21713914 0.78 HTR6 (0.53) HTR6KMT2APKMLMNA
SCHEMBL6799277 0.77 GBA1 (0.69) HTR6MEN1KMT2AALDH1A1PKM
SCHEMBL6900381 0.76 TGM2 (0.50)
SCHEMBL14102428 0.76 SMN1; SMN2 (0.46) HTR6KMT2AALDH1A1TSHRSMN1; SMN2

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-20080176838-A1 Dpp-IV Inhibitors SANTHERA PHARMACEUTICALS (DEUTSCHLAND) AG (DE) 2008-07-24 US disclosed
US-20080176838-A1 Dpp-IV Inhibitors SANTHERA PHARMACEUTICALS (DEUTSCHLAND) AG (DE) 2008-07-24 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-20080176838-A1 Dpp-IV Inhibitors DPP4, DPP9, DPP7 HTR6 2224/4885MEN1 4498/4885KMT2A 1391/4885

“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.