SCHEMBL2934963

SCHEMBL2934963

CCCCc1cc2c(cc1O)OC(=O)CC2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.41
ALDH2 P05091 1/20 0.39
ALDH3A1 P30838 1/20 0.39
ALDH1A1 P00352 6/20 0.38
KDM4E B2RXH2 6/20 0.38
GAA P10253 5/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
MAPK1 P28482 2/20 0.38
HTT P42858 4/20 0.37
MAPT P10636 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAOB P27338 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX5 P09917 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ERAP1 Q9NZ08 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
SCHEMBL2935573 0.94 MEN1 (0.43) TYRALDH2ALDH3A1ALDH1A1KDM4E
SCHEMBL2932666 0.94 MEN1 (0.43) TYRALDH2ALDH3A1ALDH1A1KDM4E
SCHEMBL2934063 0.86 ALDH2 (0.43) ALDH2ALDH3A1ALDH1A1KDM4EGAA
SCHEMBL11791192 0.76 ALDH2 (0.46) ALDH2ALDH3A1ALDH1A1KDM4EMAOB
SCHEMBL2936330 0.75 CNR2 (0.38) ALDH2ALDH3A1CNR2CNR1
SCHEMBL14282559 0.74 SKP2 (0.38) ALDH2ALDH3A1ALDH1A1MAPK1HTT
SCHEMBL13389081 0.73 ALDH2 (0.53) ALDH2ALDH3A1ALDH1A1KDM4EGAA
SCHEMBL6832877 0.72 ALDH2 (0.51) ALDH2ALDH3A1MAOBTSHR
SCHEMBL28794241 0.72 TYR (0.36) TYRALDH1A1KDM4EGAAMEN1
SCHEMBL12640663 0.72 TYR (0.50) TYRALDH1A1KDM4EGAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100291009-A1 PREPARATION COMPRISING CHROMAN-2-ONE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-11-18 US disclosed
US-20100291009-A1 PREPARATION COMPRISING CHROMAN-2-ONE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-11-18 US disclosed
US-20100291009-A1 PREPARATION COMPRISING CHROMAN-2-ONE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2010-11-18 US disclosed
EP-2229169-A1 PREPARATION CONTAINING CHROMANE-2-ONE DERIVATIVES Merck Patent GmbH (DE) 2010-09-22 EP disclosed
WO-2009089880-A1 PREPARATION CONTAINING CHROMANE-2-ONE DERIVATIVES MERCK PATENT GMBH (DE) 2009-07-23 WO disclosed
WO-2009089880-A1 PREPARATION CONTAINING CHROMANE-2-ONE DERIVATIVES MERCK PATENT GMBH (DE) 2009-07-23 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-20100291009-A1 PREPARATION COMPRISING CHROMAN-2-ONE DERIVATIVES RCC1, RB1, RCC2 TYR 60/4885ALDH2 3443/4885ALDH3A1 2010/4885

“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.