SCHEMBL5723948

SCHEMBL5723948

O=C(c1csc(N2CC(O)C2)n1)N1CCSCC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.40
CNR2 P34972 1/20 0.38
HPGD P15428 4/20 0.36
RAB9A P51151 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
AR P10275 2/20 0.36
TRPC3 Q13507 3/20 0.36
TRPC6 Q9Y210 3/20 0.36
HRH3 Q9Y5N1 1/20 0.35
NPC1 O15118 1/20 0.34
ALOX15 P16050 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL5724005 0.89 HTR2C (0.44) HTR2CHPGDRAB9AALDH1A1HSD17B10
SCHEMBL5725358 0.89 HTR2C (0.42) HTR2CHPGDRAB9AALDH1A1HSD17B10
SCHEMBL5723590 0.88 HTR2C (0.46) HTR2CHPGDRAB9AALDH1A1HSD17B10
SCHEMBL5724485 0.85 TSHR (0.44) HTR2CHPGDRAB9ATRPC3TRPC6
SCHEMBL5724039 0.85 HTR2C (0.50) HTR2CRAB9AALDH1A1HSD17B10L3MBTL1
SCHEMBL5724396 0.83 HRH3 (0.37) HTR2CCNR2HPGDRAB9AL3MBTL1
SCHEMBL5724329 0.83 HPGD (0.35) CNR2HPGDRAB9ATRPC3TRPC6
SCHEMBL5724462 0.79 HRH3 (0.40) HTR2CTRPC3TRPC6HRH3
SCHEMBL5723994 0.77 HRH3 (0.46) RAB9AL3MBTL1HRH3NPC1SMN1; SMN2
SCHEMBL5724414 0.74 SCD (0.36) HTR2CCNR2HPGDRAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1340757-B1 1-METHYLCARBAPENEM DERIVATIVES SANKYO CO (JP) 2006-10-11 EP disclosed
US-7001897-B2 1-methylcarbapenem derivatives SANKYO COMPANY, LIMITED (JP) 2006-02-21 US disclosed
US-20040014962-A1 1-Methylcarbapenem derivatives SANKYO COMPANY, LIMITED (JP) 2004-01-22 US disclosed
EP-1340757-A1 1-METHYLCARBAPENEM DERIVATIVES Sankyo Company, Limited (JP) 2003-09-03 EP 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-20040014962-A1 1-Methylcarbapenem derivatives CD14, CPT1A, ACMSD HTR2C 4623/4885CNR2 1743/4885HPGD 1268/4885

“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.