SCHEMBL6284359

SCHEMBL6284359

CCC(=O)CCC(=O)c1ccc(OC)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.63
MAPT P10636 1/20 0.62
PDE4B Q07343 1/20 0.60
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
HDAC1 Q13547 5/20 0.58
HDAC8 Q9BY41 5/20 0.58
HDAC3 O15379 3/20 0.58
HDAC4 P56524 3/20 0.58
HDAC7 Q8WUI4 3/20 0.58
HDAC2 Q92769 3/20 0.58
HDAC10 Q969S8 3/20 0.58
HDAC11 Q96DB2 3/20 0.58
HDAC6 Q9UBN7 3/20 0.58
HDAC9 Q9UKV0 3/20 0.58
HDAC5 Q9UQL6 3/20 0.58
GSK3B P49841 1/20 0.58
ALDH1A1 P00352 3/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
NR1I2 O75469 1/20 0.53

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
SCHEMBL7916157 0.90 PDE4B (0.66) MMP1MAPTPDE4BNPC1RAB9A
SCHEMBL16552644 0.89 MMP1 (0.76) MMP1MAPTPDE4BNPC1RAB9A
SCHEMBL6286678 0.88 MMP1 (0.61) MMP1MAPTPDE4BNPC1RAB9A
SCHEMBL1826616 0.88 MMP1 (0.61) MMP1MAPTPDE4BNPC1RAB9A
SCHEMBL9701428 0.84 ALDH1A1 (0.60) MMP1MAPTPDE4BNPC1HDAC1
SCHEMBL705208 0.83 MAPT (0.68) MMP1MAPTPDE4BNPC1RAB9A
SCHEMBL17636040 0.83 MMP1 (0.59) MMP1MAPTPDE4BNPC1RAB9A
SCHEMBL459470 0.83 KMT2A (0.70) MMP1MAPTPDE4BNPC1RAB9A
SCHEMBL1821483 0.82 MMP1 (0.55) MMP1MAPTPDE4BNPC1RAB9A
SCHEMBL8984256 0.82 HDAC8 (0.58) MMP1MAPTPDE4BNPC1RAB9A

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-3156398-A1 AGONISTS OF THE CHEMOKINE RECEPTOR CXCR3 Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2017-04-19 EP disclosed
US-6911468-B2 Tyrosine phosphatase inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-06-28 US disclosed
US-20030144338-A1 Tyrosine phosphatase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-07-31 US disclosed
EP-1284260-A1 TYROSINE PHOSPHATASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2003-02-19 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-20030144338-A1 Tyrosine phosphatase inhibitors PTPRC, PTPN1, PTPRM MMP1 1971/4885MAPT 4800/4885PDE4B 2748/4885

“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.