SCHEMBL20091602

SCHEMBL20091602

O=C(CCSSc1ccccc1)NCCNC(=O)NCCC(=O)ON1C(=O)CCC1=O

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.38
ALDH1A1 P00352 7/20 0.36
HPGD P15428 5/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
RAB9A P51151 1/20 0.36
TSHR P16473 1/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPC1 O15118 1/20 0.33
USP2 O75604 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
NAMPT P43490 1/20 0.32

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
SCHEMBL9258692 0.84 PSMB8 (0.37) HSD17B10ALDH1A1HPGDKMT2ARAB9A
SCHEMBL18510196 0.82 HPGD (0.44) ALDH1A1HPGDKMT2AMEN1RAB9A
SCHEMBL18510194 0.82 HPGD (0.44) ALDH1A1HPGDKMT2AMEN1RAB9A
SCHEMBL20968628 0.81 HPGD (0.36) HSD17B10ALDH1A1HPGDKMT2AMEN1
SCHEMBL18510177 0.80 HPGD (0.45) HSD17B10ALDH1A1HPGDKMT2AMEN1
SCHEMBL18510191 0.80 HPGD (0.45) HSD17B10ALDH1A1HPGDKMT2AMEN1
SCHEMBL18519268 0.80 HPGD (0.45) HSD17B10ALDH1A1HPGDKMT2AMEN1
SCHEMBL31005443 0.75 HPGD (0.43) HSD17B10ALDH1A1HPGDRAB9APOLB
SCHEMBL14273419 0.75 HPGD (0.43) HSD17B10ALDH1A1HPGDRAB9APOLB
SCHEMBL23768443 0.75 HPGD (0.33) HPGDSMN1; SMN2

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-3912982-A1 NOVEL HYDROPHILIC LINKERS AND LIGAND-DRUG CONJUGATES THEREOF Hangzhou Dac Biotech Co., Ltd (CN) 2021-11-24 EP disclosed
EP-3271329-B1 NOVEL HYDROPHILIC LINKERS AND LIGAND-DRUG CONJUGATES THEREOF HANGZHOU DAC BIOTECH CO LTD (CN) 2021-08-18 EP disclosed
US-10456479-B2 Hydrophilic linkers and ligand-drug conjugates thereof HANGZHOU DAC BIOTECH CO., LTD. (CN) 2019-10-29 US disclosed
US-20180110876-A1 NOVEL HYDROPHILIC LINKERS AND LIGAND-DRUG CONJUGATES THEREOF HANGZHOU DAC BIOTECH CO., LTD. (CN) 2018-04-26 US 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-10456479-B2 Hydrophilic linkers and ligand-drug conjugates thereof CD44, SELPLG, EPCAM HSD17B10 997/4885ALDH1A1 1069/4885HPGD 1325/4885
US-20180110876-A1 NOVEL HYDROPHILIC LINKERS AND LIGAND-DRUG CONJUGATES THEREOF CD44, HACD3, HACD2 HSD17B10 1009/4885ALDH1A1 1285/4885HPGD 1722/4885

“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.