SCHEMBL21787787

SCHEMBL21787787

COC(=O)c1cc(C=O)oc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.47
KDM4E B2RXH2 6/20 0.47
ABL1 P00519 1/20 0.40
GAA P10253 2/20 0.38
HPGD P15428 3/20 0.38
HTT P42858 1/20 0.38
LMNA P02545 2/20 0.37
POLB P06746 1/20 0.37
HSD17B10 Q99714 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA7 P43166 2/20 0.36
CA9 Q16790 2/20 0.36
CA14 Q9ULX7 2/20 0.36
PDK2 Q15119 1/20 0.36
PDK4 Q16654 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL1936673 0.81 ALDH1A1 (0.48) ALDH1A1KDM4EGAAHPGDHTT
SCHEMBL29072286 0.75 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDHTTLMNA
SCHEMBL21776796 0.74 DAO (0.53) ALDH1A1KDM4EABL1GAAHPGD
SCHEMBL21787713 0.72 CA12 (0.41) ALDH1A1KDM4EABL1GAAHPGD
SCHEMBL21788045 0.72 ABL1 (0.44) ALDH1A1KDM4EABL1GAAHPGD
SCHEMBL15784497 0.71 HSD17B10 (0.60) ALDH1A1KDM4ELMNAPOLBHSD17B10
SCHEMBL21776750 0.71 ABL1 (0.39) ALDH1A1KDM4EABL1GAAHPGD
SCHEMBL19506015 0.71 CA1 (0.39) ALDH1A1KDM4EABL1GAAHPGD
SCHEMBL19506014 0.70 ALDH1A1 (0.51) ALDH1A1ABL1GAAHTTLMNA
SCHEMBL74642 0.68 PDE4A (0.44) ALDH1A1KDM4EHPGDLMNACYP1A2

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-20210346336-A1 FURAN DERIVATIVES AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2021-11-11 US disclosed
WO-2020043821-A1 FURAN DERIVATIVES AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2020-03-05 WO 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-20210346336-A1 FURAN DERIVATIVES AS BROMODOMAIN INHIBITORS BRD4, BRD3, BRDT ALDH1A1 2126/4885KDM4E 820/4885ABL1 358/4885

“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.