SCHEMBL5725358

SCHEMBL5725358

O=C(c1csc(N2CC(O)C2)n1)N1CCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.42
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
ATM Q13315 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TRPC3 Q13507 3/20 0.38
TRPC6 Q9Y210 3/20 0.38
GFER P55789 1/20 0.38
HRH3 Q9Y5N1 3/20 0.38
GNE Q9Y223 1/20 0.37

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 0.97 HTR2C (0.44) HTR2CNPC1ALDH1A1HPGDALOX15
SCHEMBL5723590 0.96 HTR2C (0.46) HTR2CNPC1ALDH1A1HPGDALOX15
SCHEMBL5723948 0.89 HTR2C (0.40) HTR2CNPC1ALDH1A1HPGDALOX15
SCHEMBL5724485 0.88 TSHR (0.44) HTR2CNPC1HPGDRAB9ASMN1; SMN2
SCHEMBL5724039 0.88 HTR2C (0.50) HTR2CALDH1A1RAB9AHSD17B10L3MBTL1
SCHEMBL5724667 0.82 KMT2A (0.41) HTR2CNPC1ALDH1A1HPGDALOX15
SCHEMBL18131017 0.82 HTR2C (0.51) HTR2CNPC1ALDH1A1HPGDALOX15
SCHEMBL5724610 0.82 KMT2A (0.39) HTR2CNPC1ALDH1A1HPGDALOX15
SCHEMBL5724462 0.81 HRH3 (0.40) HTR2CMEN1KMT2ATRPC3TRPC6
SCHEMBL5724025 0.80 KMT2A (0.43) HTR2CNPC1ALDH1A1HPGDALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1289498-C 1-methylcarbapenem derivatives SANKYO CO (JP) 2006-12-13 CN disclosed
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
CN-1486317-A 1-methylcarbapenem derivatives ������������ʽ���� 2004-03-31 CN 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 4623/4885NPC1 383/4885ALDH1A1 637/4885

“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.