SCHEMBL9109799

SCHEMBL9109799

CCOc1ccc(C/C=C/C(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
MAPT P10636 2/20 0.56
SMN1; SMN2 Q16637 4/20 0.53
KDM4E B2RXH2 3/20 0.53
POLB P06746 4/20 0.48
MAOB P27338 2/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
MAPK1 P28482 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NQO1 P15559 1/20 0.47
KMT2A Q03164 2/20 0.47
MAOA P21397 1/20 0.47
HTT P42858 1/20 0.47
PARP10 Q53GL7 1/20 0.46
PLA2G4B P0C869 1/20 0.45

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
SCHEMBL9109802 1.00 ALDH1A1 (0.56) ALDH1A1MAPTSMN1; SMN2KDM4EPOLB
SCHEMBL12549306 0.84 POLB (0.49) ALDH1A1MAPTSMN1; SMN2KDM4EPOLB
SCHEMBL1667029 0.83 TP53 (0.57) PLA2G4B
SCHEMBL1667028 0.83 TP53 (0.57) PLA2G4B
SCHEMBL1931432 0.83 THRB (0.56) ALDH1A1SMN1; SMN2POLBNPC1RAB9A
SCHEMBL1931433 0.83 THRB (0.56) ALDH1A1SMN1; SMN2POLBNPC1RAB9A
SCHEMBL11366685 0.82 MAOB (0.46) ALDH1A1MAOBCYP2C19TDP1
SCHEMBL9112220 0.81 ALDH1A1 (0.59) ALDH1A1KDM4EMAOBCYP2C19PARP10
SCHEMBL9112229 0.81 ALDH1A1 (0.59) ALDH1A1KDM4EMAOBCYP2C19PARP10
SCHEMBL9696619 0.80 ALDH1A1 (0.50) ALDH1A1MAOBTDP1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2460810-B1 NOVEL FLAVANONE DERIVATIVE UNIV OKAYAMA NAT UNIV CORP (JP) 2015-07-15 EP disclosed
CN-104285179-A Particles for electrophoretic displays MERCK PATENT GMBH 2015-01-14 CN disclosed
US-8916526-B2 Flavanone derivative NATIONAL UNIVERSITY CORPORATION OKAYAMA UNIVERSITY (JP) 2014-12-23 US disclosed
US-20120202980-A1 Novel Flavanone Derivative NATIONAL UNIVERSITY CORPORATION OKAYAMA UNIVERSITY (JP) 2012-08-09 US disclosed
EP-2460810-A1 NOVEL FLAVANONE DERIVATIVE National University Corporation Okayama University (JP) 2012-06-06 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-20120202980-A1 Novel Flavanone Derivative GALE, VRK1, GALK1 ALDH1A1 817/4885MAPT 4011/4885SMN1; SMN2 3909/4885

“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.