SCHEMBL18928680

SCHEMBL18928680

O=C(CCCS)N1CCCCC1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.71
KMT2A Q03164 3/20 0.62
L3MBTL1 Q9Y468 2/20 0.62
MEN1 O00255 2/20 0.62
TDP1 Q9NUW8 1/20 0.62
SMN1; SMN2 Q16637 2/20 0.52
ALDH1A1 P00352 2/20 0.52
HPGD P15428 3/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
GAA P10253 1/20 0.48
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ACHE P22303 1/20 0.46

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
SCHEMBL8285857 0.86 ATM (0.62) ATMKMT2AL3MBTL1MEN1TDP1
SCHEMBL28366947 0.86 ATM (0.85) ATMKMT2AL3MBTL1MEN1TDP1
SCHEMBL10722542 0.86 ATM (0.85) ATMKMT2AL3MBTL1MEN1TDP1
SCHEMBL27487132 0.86 ATM (0.85) ATMKMT2AL3MBTL1MEN1TDP1
SCHEMBL19574089 0.86 ATM (0.95) ATMKMT2AL3MBTL1MEN1TDP1
SCHEMBL10722543 0.84 ATM (0.81) ATMKMT2AL3MBTL1MEN1TDP1
SCHEMBL4602646 0.84 ATM (0.65) ATMKMT2AL3MBTL1MEN1TDP1
SCHEMBL8628664 0.81 ATM (0.68) ATMKMT2AL3MBTL1MEN1TDP1
SCHEMBL3004492 0.80 ATM (0.74) ATMKMT2AL3MBTL1MEN1TDP1
SCHEMBL20985659 0.80 ATM (0.74) ATMKMT2AL3MBTL1MEN1TDP1

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-2872157-B1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS HANGZHOU DAC BIOTECH CO LTD (CN) 2020-01-22 EP disclosed
EP-3348280-A1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS Hangzhou Dac Biotech Co., Ltd (CN) 2018-07-18 EP disclosed
EP-3210627-A1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS Hangzhou Dac Biotech Co., Ltd (CN) 2017-08-30 EP disclosed
US-20170157262-A1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS HANGZHOU DAC BIOTECH CO., LTD (CN) 2017-06-08 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 (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-20170157262-A1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS CD4, CD2, CD47 ATM 2988/4885KMT2A 2737/4885L3MBTL1 43/4885

“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.