SCHEMBL7034728

SCHEMBL7034728

CN1CCN(c2cc(C(N)=O)ccc2OCc2ccccc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.53
MAPK1 P28482 2/20 0.53
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
ALDH1A1 P00352 2/20 0.53
KDM4E B2RXH2 1/20 0.53
GAA P10253 1/20 0.51
TSHR P16473 1/20 0.51
HTR6 P50406 2/20 0.49
LRRK2 Q5S007 2/20 0.48
PARP10 Q53GL7 1/20 0.48
NEK2 P51955 1/20 0.48
AVPR2 P30518 1/20 0.46
AVPR1A P37288 1/20 0.46
USP2 O75604 2/20 0.46
MAPT P10636 1/20 0.46
ESR2 Q92731 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
HPGD P15428 1/20 0.46
HRH4 Q9H3N8 1/20 0.46

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
SCHEMBL6972474 0.84 HSD17B10 (0.59) HSD17B10MAPK1KMT2AMEN1ALDH1A1
SCHEMBL7034737 0.82 HTR6 (0.54) HSD17B10MAPK1KMT2AMEN1ALDH1A1
SCHEMBL17659126 0.80 HRH3 (0.59) HSD17B10MAPK1KMT2AMEN1ALDH1A1
SCHEMBL1397384 0.80 KDM4E (0.63) HSD17B10ALDH1A1KDM4EHTR6SLC2A1
Hydrochloric Acid SCHEMBL3072094 0.79 KDM4E (0.62) HSD17B10ALDH1A1KDM4EHTR6SLC2A1
Hydrochloric Acid SCHEMBL6343776 0.79 KDM4E (0.62) HSD17B10ALDH1A1KDM4EHTR6SLC2A1
SCHEMBL14355885 0.78 HTR1A (0.68) HSD17B10MAPK1KMT2AMEN1ALDH1A1
SCHEMBL15777337 0.77 KDM1A (0.68) HSD17B10MAPK1KMT2AMEN1ALDH1A1
SCHEMBL7034866 0.77 HTR7 (0.57) HSD17B10MAPK1ALDH1A1USP2MAPT
SCHEMBL4278858 0.77 PARP10 (0.64) HSD17B10MAPK1ALDH1A1KDM4EPARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030069233-A1 Sulphonamide derivatives, process for their preparation, and their use as medicaments SMITHKLINE BEECHAM P.L.C. 2003-04-10 US claimed
US-6423717-B1 NERVOUS SYSTEM DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 2002-07-23 US claimed
EP-0946539-A1 SULPHONAMIDE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS SMITHKLINE BEECHAM PLC (GB) 1999-10-06 EP claimed
WO-1998027081-A1 SULPHONAMIDE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS SMITHKLINE BEECHAM PLC (GB) 1998-06-25 WO claimed
US-20030069233-A1 Sulphonamide derivatives, process for their preparation, and their use as medicaments SMITHKLINE BEECHAM P.L.C. 2003-04-10 US disclosed
US-6423717-B1 NERVOUS SYSTEM DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 2002-07-23 US disclosed
EP-0946539-A1 SULPHONAMIDE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS SMITHKLINE BEECHAM PLC (GB) 1999-10-06 EP disclosed
WO-1998027081-A1 SULPHONAMIDE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS SMITHKLINE BEECHAM PLC (GB) 1998-06-25 WO 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-20030069233-A1 Sulphonamide derivatives, process for their preparation, and their use as medicaments TPMT, MPST, STS HSD17B10 3660/4885MAPK1 2345/4885KMT2A 1602/4885

“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.