SCHEMBL20588779

SCHEMBL20588779

O=c1cc(CCl)c2cc3c(cc2o1)OCO3

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 4/20 0.61
PON1 P27169 3/20 0.50
DYRK1A Q13627 1/20 0.50
ALDH1A1 P00352 6/20 0.49
HPGD P15428 4/20 0.49
KDM4E B2RXH2 4/20 0.49
TSHR P16473 3/20 0.49
GAA P10253 1/20 0.49
HSD17B10 Q99714 1/20 0.49
USP2 O75604 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 2/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
MEN1 O00255 1/20 0.42
CCR4 P51679 1/20 0.42
NPC1 O15118 1/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX12 P18054 1/20 0.41
AKR1B1 P15121 1/20 0.40

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
SCHEMBL572596 0.83 ALDH1A1 (0.49) MCL1ALDH1A1HPGDKDM4ETSHR
SCHEMBL13739810 0.80 MCL1 (0.66) MCL1ALDH1A1HPGDKDM4ETSHR
SCHEMBL19354082 0.78 ALDH1A1 (0.44) MCL1ALDH1A1HPGDKDM4ETSHR
SCHEMBL7731593 0.77 ALDH1A1 (0.47) MCL1ALDH1A1HPGDKDM4ETSHR
SCHEMBL30696156 0.76 ALDH1A1 (0.42) MCL1ALDH1A1HPGDKDM4ETSHR
SCHEMBL24302900 0.76 ALDH1A1 (0.51) MCL1ALDH1A1HPGDKDM4ETSHR
SCHEMBL30696157 0.76 ALDH1A1 (0.51) MCL1ALDH1A1HPGDKDM4ETSHR
SCHEMBL8702627 0.76 MCL1 (1.00) MCL1PON1DYRK1AALDH1A1HPGD
SCHEMBL24270279 0.76 ALDH1A1 (0.81) MCL1ALDH1A1HPGDKDM4ETSHR
SCHEMBL15836636 0.74 KMT2A (0.72) ALDH1A1HPGDKDM4ETSHRUSP2

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-20200223837-A1 BENZOFURAN AMIDES AND HETEROAROMATIC ANALOGUES THEREOF FOR USE IN THERAPY EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 2020-07-16 US disclosed
EP-3638664-A1 BENZOFURAN AMIDES AND HETEROAROMATIC ANALOGUES THEREOF FOR USE IN THERAPY European Molecular Biology Laboratory (DE) 2020-04-22 EP disclosed
WO-2018229193-A1 BENZOFURAN AMIDES AND HETEROAROMATIC ANALOGUES THEREOF FOR USE IN THERAPY EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 2018-12-20 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-20200223837-A1 BENZOFURAN AMIDES AND HETEROAROMATIC ANALOGUES THEREOF FOR USE IN THERAPY SUCNR1, CBR1, CYP2A13 MCL1 2773/4885PON1 2102/4885DYRK1A 943/4885

“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.