SCHEMBL6405599

SCHEMBL6405599

SC1CCN(c2nccs2)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.45
HTT P42858 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
MEN1 O00255 1/20 0.40
GRM5 P41594 1/20 0.40
GRM1 Q13255 1/20 0.40
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
RECQL P46063 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP3A4 P08684 1/20 0.38
CHI3L1 P36222 2/20 0.38
CHIT1 Q13231 1/20 0.38
CHI3L2 Q15782 1/20 0.38
CHIA Q9BZP6 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
SCHEMBL4525971 0.79 HPGD (0.49) HPGDHSD17B10HTTNPC1RAB9A
SCHEMBL2861212 0.79 HPGD (0.46) HPGDHSD17B10HTTNPC1RAB9A
SCHEMBL4525966 0.79 HPGD (0.49) HPGDHSD17B10HTTNPC1RAB9A
SCHEMBL1266169 0.79 HPGD (0.46) HPGDHSD17B10HTTNPC1RAB9A
SCHEMBL13035394 0.79 HPGD (0.46) HPGDHSD17B10HTTNPC1RAB9A
Hydrochloric Acid SCHEMBL974366 0.78 HPGD (0.45) HPGDHSD17B10HTTNPC1RAB9A
SCHEMBL12988231 0.76 HRH3 (0.46) HPGDHSD17B10HTTNPC1RAB9A
SCHEMBL31421086 0.76 HPGD (0.43) HPGDHSD17B10HTTNPC1RAB9A
SCHEMBL11308206 0.76 NPC1 (0.38) HPGDHSD17B10HTTNPC1RAB9A
SCHEMBL20243707 0.75 HPGD (0.51) HPGDHSD17B10HTTNPC1RAB9A

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
US-20050004092-A1 Penem derivatives and antimicrobial agent containing the same DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2005-01-06 US disclosed
EP-0757051-B1 PENEM DERIVATIVES AND ANTIMICROBIAL AGENT CONTAINING THE SAME DAIICHI SUNTORY PHARMA CO LTD (JP) 2003-10-29 EP disclosed
US-6051569-A 1'S, 5R, 6R-carbapenem derivatives and antimicrobial agents comprising the same SUNTORY LIMITED (JP) 2000-04-18 US disclosed
EP-0826687-A1 Carbapenem derivatives and antimicrobial agents comprising the same SUNTORY LIMITED (JP) 1998-03-04 EP disclosed
EP-0774465-A1 Penem derivatives and antimicrobial agents containing the same SUNTORY LIMITED (JP) 1997-05-21 EP disclosed
EP-0757051-A1 PENEM DERIVATIVES AND ANTIMICROBIAL AGENT CONTAINING THE SAME SUNTORY LIMITED (JP) 1997-02-05 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-20050004092-A1 Penem derivatives and antimicrobial agent containing the same MRPL21, MRPS2, MRPS28 HPGD 3127/4885HSD17B10 2661/4885HTT 2665/4885

“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.