SCHEMBL19787655

SCHEMBL19787655

COc1ccc(C2c3ccc(OC)cc3OCC2c2ccc(O)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.53
ESR2 Q92731 5/20 0.53
MAPT P10636 2/20 0.48
MAPK1 P28482 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
EDNRB P24530 1/20 0.47
EDNRA P25101 1/20 0.47
CYP19A1 P11511 1/20 0.45
ALOX15 P16050 2/20 0.45
ALOX12 P18054 2/20 0.45
ABCB1 P08183 2/20 0.45
ALDH1A1 P00352 2/20 0.43
USP2 O75604 1/20 0.43
CYP3A4 P08684 1/20 0.43
DRD2 P14416 1/20 0.42
DRD3 P35462 1/20 0.42
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 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
SCHEMBL20831831 0.95 ESR1 (0.58) ESR1ESR2MAPTMAPK1TDP1
SCHEMBL15013033 0.95 ESR1 (0.58) ESR1ESR2MAPTMAPK1TDP1
SCHEMBL20831829 0.95 ESR1 (0.58) ESR1ESR2MAPTMAPK1TDP1
SCHEMBL15312307 0.95 ESR1 (0.58) ESR1ESR2MAPTMAPK1TDP1
SCHEMBL239999 0.95 ESR1 (0.58) ESR1ESR2MAPTMAPK1TDP1
SCHEMBL2604720 0.95 ESR1 (0.58) ESR1ESR2MAPTMAPK1TDP1
SCHEMBL30362855 0.95 ESR1 (0.58) ESR1ESR2MAPTMAPK1TDP1
SCHEMBL22536180 0.94 ESR1 (0.60) ESR1ESR2MAPTMAPK1TDP1
SCHEMBL7023880 0.94 ESR1 (0.60) ESR1ESR2MAPTMAPK1TDP1
SCHEMBL7023886 0.94 ESR1 (0.60) ESR1ESR2MAPTMAPK1TDP1

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-10980774-B2 Combination therapies MEI PHARMA, INC. (US) 2021-04-20 US disclosed
US-20180015067-A1 COMBINATION THERAPIES Aardvark Therapeutics, Inc. 2018-01-18 US 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 (2 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-10980774-B2 Combination therapies PCK2, PDK1, PCK1 ESR1 2467/4885ESR2 1403/4885MAPT 3327/4885
US-20180015067-A1 COMBINATION THERAPIES PCK2, PDK1, PCK1 ESR1 2467/4885ESR2 1403/4885MAPT 3327/4885

“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.