SCHEMBL7140331

SCHEMBL7140331

CCCCC#CCCCCCCCC[O]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 5/20 0.50
HMGCR P04035 3/20 0.50
RECQL P46063 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
ALOX12 P18054 1/20 0.42
BLM P54132 1/20 0.42
KMT2A Q03164 1/20 0.42
MCL1 Q07820 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
EPHX2 P34913 4/20 0.39
RAB9A P51151 1/20 0.39
TSHR P16473 2/20 0.38
THRB P10828 1/20 0.35

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
SCHEMBL5055925 1.00 PTPN7 (0.50) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL5063352 1.00 PTPN7 (0.50) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL5061785 0.97 PTPN7 (0.46) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL5053118 0.95 PTPN7 (0.56) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL5053259 0.95 PTPN7 (0.56) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL5053208 0.92 PTPN7 (0.52) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL5057471 0.90 PTPN7 (0.45) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL5061640 0.90 PTPN7 (0.56) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL1329998 0.90 PTPN7 (0.56) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL5056023 0.90 PTPN7 (0.45) PTPN7HMGCRRECQLTDP1KDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6511965-B2 For therapy and prophylaxis of inflammatory disorders, autoimmune diseases or septicemia SANKYO COMPANY, LIMITED (JP) 2003-01-28 US disclosed
US-20020161221-A1 Ether type lipid a 1-carboxylic acid analogs SANKYO COMPANY, LIMITED (JP) 2002-10-31 US disclosed
EP-1152007-A1 ETHER TYPE LIPID A1-CARBOXYLIC ACID ANALOGUES Sankyo Company, Limited (JP) 2001-11-07 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-20020161221-A1 Ether type lipid a 1-carboxylic acid analogs MSR1, ELOVL1, FFAR1 PTPN7 2157/4885HMGCR 225/4885RECQL 4107/4885

“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.