SCHEMBL5723770

SCHEMBL5723770

CC(=O)SC1CN(c2nc(CNC(=O)c3ccco3)cs2)C1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.55
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MAPT P10636 2/20 0.45
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 6/20 0.44
GAA P10253 1/20 0.44
LMNA P02545 3/20 0.43
TP53 P04637 2/20 0.43
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
DNM1L O00429 1/20 0.40
HTT P42858 1/20 0.39

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
SCHEMBL5724346 0.86 HPGD (0.61) HPGDNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL5724501 0.81 HPGD (0.53) HPGDNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL5723782 0.77 HPGD (0.53) HPGDNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL5723668 0.75 KDM4E (0.48) HPGDSMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL5723789 0.72 HPGD (0.52) HPGDNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL5724067 0.71 POLB (0.41) HPGDNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL5724038 0.71 PARP1 (0.38) MAPTALDH1A1HTT
SCHEMBL5723956 0.71 HRH3 (0.33) DNM1L
SCHEMBL5724161 0.70 DNM1L (0.36) DNM1L
SCHEMBL5724215 0.69 OGA (0.42) HPGDNPC1RAB9AGAA

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-7148357-B2 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines SCHERING AG (DE) 2006-12-12 US 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
US-20040147535-A1 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2004-07-29 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 (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-20040014962-A1 1-Methylcarbapenem derivatives CD14, CPT1A, ACMSD HPGD 1268/4885NPC1 383/4885RAB9A 3028/4885
US-20040147535-A1 VEGFR-2 and VEGFR-3 inhibitory anthranilamide pyridines FLT4, KDR, FLT1 HPGD 2498/4885NPC1 4839/4885RAB9A 1702/4885

“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.