SCHEMBL2807685

SCHEMBL2807685

Cc1cc(C(=O)O)c(C(=O)O)cc1N.[KH]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.50
KMT2A Q03164 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
MEN1 O00255 2/20 0.50
GABRP O00591 2/20 0.47
GABRD O14764 2/20 0.47
GABRA1 P14867 2/20 0.47
GABRB1 P18505 2/20 0.47
GABRG2 P18507 2/20 0.47
GABRB3 P28472 2/20 0.47
GABRA5 P31644 2/20 0.47
GABRA3 P34903 2/20 0.47
GABRA2 P47869 2/20 0.47
GABRB2 P47870 2/20 0.47
GABRA4 P48169 2/20 0.47
GABRE P78334 2/20 0.47
GABRA6 Q16445 2/20 0.47
GABRG1 Q8N1C3 2/20 0.47
GABRG3 Q99928 2/20 0.47
GABRQ Q9UN88 2/20 0.47

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
SCHEMBL2813599 0.98 KDM4E (0.52) KDM4EKMT2ATDP1MEN1GABRP
SCHEMBL2810184 0.95 KDM4E (0.50) KDM4EKMT2ATDP1MEN1GABRP
SCHEMBL274410 0.86 GABRP (0.52) KDM4EKMT2ATDP1MEN1GABRP
SCHEMBL30280663 0.86 GABRP (0.52) KDM4EKMT2ATDP1MEN1GABRP
SCHEMBL13365081 0.86 KDM4E (0.50) KDM4EKMT2ATDP1MEN1GABRP
SCHEMBL28347494 0.86 KDM4E (0.50) KDM4EKMT2ATDP1MEN1GABRP
SCHEMBL4732592 0.86 GABRP (0.52) KDM4EKMT2ATDP1MEN1GABRP
SCHEMBL2811742 0.85 GLA (0.45) KDM4EKMT2ATDP1MEN1GABRP
SCHEMBL2811740 0.85 GLA (0.45) KDM4EKMT2ATDP1MEN1GABRP
SCHEMBL12398857 0.83 GRM1 (0.51) KDM4EKMT2ATDP1MEN1GABRP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100240908-A1 ACETYLENE COMPOUND FUJIFILM CORPORATION (JP) 2010-09-23 US 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 KDM4E 3178/4885KMT2A 730/4885TDP1 4533/4885

“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.