SCHEMBL11932004

SCHEMBL11932004

Cc1cccc(S(=O)(=O)N(C(C)C)C2CCN(C(=O)[C@H](Cc3ccccc3)NCC3CCCCC3)CC2)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ST14 Q9Y5Y6 3/20 0.41
HPN P05981 1/20 0.41
HGFAC Q04756 1/20 0.41
PLAU P00749 2/20 0.41
F2 P00734 2/20 0.41
F10 P00742 1/20 0.41
PLG P00747 1/20 0.41
UBE2M P61081 1/20 0.40
DCUN1D1 Q96GG9 1/20 0.40
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
REN P00797 2/20 0.39
MAPK1 P28482 1/20 0.39
CCKBR P32239 2/20 0.39
KMT2A Q03164 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38

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
SCHEMBL3485797 0.90 LMNA (0.46) ST14PLAUF2F10PLG
SCHEMBL3485793 0.90 LMNA (0.46) ST14PLAUF2F10PLG
SCHEMBL22951465 0.85 UBE2M (0.41) ST14PLAUF2F10PLG
SCHEMBL13541745 0.82 OPRD1 (0.53) UBE2MDCUN1D1HTR2AHTR2C
SCHEMBL22951470 0.78 UBE2M (0.39) ST14PLAUF2F10PLG
SCHEMBL3485590 0.77 CACNA1B (0.44) ST14PLAUF2F10PLG
SCHEMBL3485592 0.77 CACNA1B (0.44) ST14PLAUF2F10PLG
SCHEMBL13541740 0.76 HTR2A (0.50) F2UBE2MDCUN1D1ALDH1A1HTR2A
SCHEMBL22951219 0.75 KDM4E (0.45) UBE2MDCUN1D1ALDH1A1KDM4EMAPK1
SCHEMBL3486058 0.72 CACNA1B (0.47) UBE2MDCUN1D1KMT2A

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-20230165812-A1 NOCICEPTOR NEURONS CONTROL CANCER IMMUNOSURVEILLANCE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-06-01 US disclosed
US-20120172429-A1 PERMANENTLY CHARGED SODIUM AND CALCIUM CHANNEL BLOCKERS AS ANTI- INFLAMMATORY AGENTS THE GENERAL HOSPITAL CORPORATION 2012-07-05 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 (2 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-20120172429-A1 PERMANENTLY CHARGED SODIUM AND CALCIUM CHANNEL BLOCKERS AS ANTI- INFLAMMATORY AGENTS TRPV1, CACNA1B, ORAI1 ST14 4173/4885HPN 2017/4885HGFAC 3369/4885
US-20230165812-A1 NOCICEPTOR NEURONS CONTROL CANCER IMMUNOSURVEILLANCE OPRL1, MRGPRX1, RAMP1 ST14 1293/4885HPN 775/4885HGFAC 4324/4885

“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.