SCHEMBL16894642

SCHEMBL16894642

COc1cc(OC)c2c(c1)C(=O)C[C@H](c1cc(OC)c(OC)c(OC)c1OC)O2

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 5/20 0.54
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 3/20 0.43
ABCG2 Q9UNQ0 3/20 0.43
MAPK1 P28482 2/20 0.43
HSD17B10 Q99714 2/20 0.43
CYP3A4 P08684 2/20 0.43
HPGD P15428 1/20 0.43
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
MAP2K3 P46734 1/20 0.41
ABCB1 P08183 2/20 0.40
AR P10275 1/20 0.40
MAOB P27338 1/20 0.38

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
SCHEMBL16894629 0.87 CYP19A1 (0.52) CYP19A1KDM4EALDH1A1ABCG2MAPK1
SCHEMBL16894635 0.81 ALDH1A1 (0.63) CYP19A1KDM4EALDH1A1ABCG2MAPK1
SCHEMBL6723899 0.79 MAOB (0.62) CYP19A1KDM4EALDH1A1ABCG2MAPK1
SCHEMBL2879029 0.79 ABCG2 (0.67) CYP19A1KDM4EALDH1A1ABCG2MAPK1
SCHEMBL5085606 0.76 CYP19A1 (0.63) CYP19A1KDM4EALDH1A1ABCG2MAPK1
SCHEMBL29286014 0.74 TAS2R31 (0.55) CYP19A1KDM4EALDH1A1ABCG2MAPK1
SCHEMBL30989212 0.74 TAS2R31 (0.55) CYP19A1KDM4EALDH1A1ABCG2MAPK1
SCHEMBL16894664 0.74 MAOB (0.60) CYP19A1ABCG2CYP3A4MAPTABCB1
SCHEMBL16894614 0.73 PTAFR (0.49) CYP19A1KDM4EALDH1A1ABCG2MAPK1
SCHEMBL10425232 0.71 ABCG2 (0.60) CYP19A1KDM4EALDH1A1ABCG2MAPK1

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-9669003-B2 Use of flavone and flavanone derivatives in preparation of sedative and hypnotic drugs JIN YONGRI (CN) 2017-06-06 US claimed
US-20150196529-A1 USE OF FLAVONE AND FLAVANONE DERIVATIVES IN PREPARATION OF SEDATIVE AND HYPNOTIC DRUGS JIN YONGRI (CN) 2015-07-16 US claimed

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-20150196529-A1 USE OF FLAVONE AND FLAVANONE DERIVATIVES IN PREPARATION OF SEDATIVE AND HYPNOTIC DRUGS CYP2D6, GATAD2A, CYP3A43 CYP19A1 1387/4885KDM4E 437/4885ALDH1A1 668/4885

“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.