SCHEMBL1471513

SCHEMBL1471513

C=CCc1cc2c(O)c(c1)Cc1cc(CC=C)cc(c1O)Cc1cc(CC=C)cc(c1O)Cc1cc(CC=C)cc(c1O)C2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRB P23467 1/20 0.47
XDH P47989 1/20 0.45
TNKS O95271 2/20 0.45
TNKS2 Q9H2K2 1/20 0.45
PARP1 P09874 1/20 0.44
GABRA1 P14867 6/20 0.44
GABRB2 P47870 6/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPT P10636 3/20 0.44
MEN1 O00255 2/20 0.44
GAA P10253 2/20 0.44
CNR1 P21554 2/20 0.44
CNR2 P34972 2/20 0.44
KMT2A Q03164 2/20 0.44
PPARG P37231 2/20 0.44
PPARD Q03181 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH2 P05091 1/20 0.44
AKR1B1 P15121 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL2493537 0.75 TNKS (0.63) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL2461750 0.73 XDH (0.48) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL215399 0.72 XDH (0.50) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL5492728 0.72 XDH (0.48) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL1473043 0.72 ADRA2A (0.35) XDHTNKSTNKS2GABRA1GABRB2
SCHEMBL1514254 0.72 XDH (0.52) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL4465266 0.72 XDH (0.52) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL8635421 0.71 XDH (0.47) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL3806192 0.71 XDH (0.47) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL719239 0.71 XDH (0.47) XDHTNKSTNKS2PARP1GABRA1

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-11472763-B2 Calixarene compound, curable composition, and cured product DIC CORPORATION (JP) 2022-10-18 US disclosed
US-20210198178-A1 CALIXARENE COMPOUND, CURABLE COMPOSITION, AND CURED PRODUCT DIC CORPORATION (JP) 2021-07-01 US disclosed
US-7915438-B1 Solid phase host compositions NORTHWESTERN UNIVERSITY (US) 2011-03-29 US disclosed
US-7585928-B2 monomers of acetylenic homo- or copolymers; cured polymers has low dielectric constant as insulating layers in microelectronic devices DOW GLOBAL TECHNOLOGIES (US) 2009-09-08 US disclosed
US-7271259-B1 Solid phase host compositions NORTHWESTERN UNIVERSITY (US) 2007-09-18 US disclosed
US-20070027278-A1 Multifunctional monomers containing bound mesogenic poragen forming moieties and polyarylene compositions therefrom DOW GLOBAL TECHNOLOGIES LLC 2007-02-01 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 (3 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-20210198178-A1 CALIXARENE COMPOUND, CURABLE COMPOSITION, AND CURED PRODUCT H1-0, CAPN1, CROCC PTPRB 4443/4885XDH 1984/4885TNKS 3708/4885
US-11472763-B2 Calixarene compound, curable composition, and cured product CAPN1, H1-0, CROCC PTPRB 4419/4885XDH 2041/4885TNKS 3694/4885
US-20070027278-A1 Multifunctional monomers containing bound mesogenic poragen forming moieties and polyarylene compositions therefrom LRBA, CD74, BMP2 PTPRB 600/4885XDH 3820/4885TNKS 3146/4885

“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.