SCHEMBL2807400

SCHEMBL2807400

C#Cc1c(Cl)ccc2c1C(=O)OC2=O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TYMS P04818 3/20 0.47
TDP1 Q9NUW8 2/20 0.35
ALOX15 P16050 1/20 0.35
ALDH1A1 P00352 2/20 0.34
TSHR P16473 2/20 0.34
CYP1A2 P05177 1/20 0.30
POLB P06746 1/20 0.30
ERCC1 P07992 1/20 0.30
MAPT P10636 1/20 0.30
ALOX12 P18054 1/20 0.30
FEN1 P39748 1/20 0.30
ERCC4 Q92889 1/20 0.30
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL2810745 0.80 ALOX15 (0.37) TYMSTDP1ALOX15ALDH1A1
SCHEMBL2710471 0.79 ALOX15 (0.35) TYMSTDP1ALOX15ALDH1A1TSHR
SCHEMBL29930656 0.79 ALOX15 (0.35) TYMSTDP1ALOX15ALDH1A1TSHR
SCHEMBL1713019 0.77 TDP1 (0.39) TDP1ALOX15ALDH1A1MAPTKDM4E
SCHEMBL29462450 0.75 TYMS (0.50) TYMSTDP1ALOX15ALDH1A1TSHR
SCHEMBL855450 0.75 TYMS (0.50) TYMSTDP1ALOX15ALDH1A1TSHR
SCHEMBL2811395 0.75 KMT2A (0.42) TDP1ALOX15ALDH1A1CYP1A2POLB
SCHEMBL4960390 0.73 TYMS (0.58) TYMSTDP1ALOX15ALDH1A1TSHR
SCHEMBL261766 0.72 TYMS (0.52) TYMSTDP1ALOX15ALDH1A1TSHR
SCHEMBL29351267 0.72 TYMS (0.52) TYMSTDP1ALOX15ALDH1A1TSHR

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-20100240908-A1 ACETYLENE COMPOUND FUJIFILM CORPORATION (JP) 2010-09-23 US disclosed
CN-101808982-A Acetylene compound FUJIFILM CORP 2010-08-18 CN disclosed
EP-2202221-A1 ACETYLENE COMPOUND Fujifilm Corporation (JP) 2010-06-30 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-20100240908-A1 ACETYLENE COMPOUND NAT1, KATNA1, KAT2B TYMS 4688/4885TDP1 4533/4885ALOX15 1994/4885

“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.