SCHEMBL9906512

SCHEMBL9906512

C=CC(=O)OCCCCCCOc1ccc2cc(C(=O)Oc3ccc(OC(=O)c4ccc5cc(OCCOC(=O)C=C)ccc5c4)c(C(=O)CC)c3)ccc2c1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.40
THRB P10828 3/20 0.38
HTT P42858 2/20 0.36
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
MAPK1 P28482 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
SCHEMBL816076 0.98 THRA (0.41) THRATHRBHTTHPGDTSHR
SCHEMBL9906525 0.98 THRA (0.41) THRATHRBHTTHPGDTSHR
SCHEMBL9906523 0.97 THRA (0.39) THRATHRBHTTHPGDTSHR
SCHEMBL9906515 0.96 THRB (0.41) THRATHRBMAPTKDM4EPOLB
SCHEMBL9906510 0.95 THRA (0.37) THRATHRBHPGDTSHRMAPT
SCHEMBL815879 0.93 KDM4E (0.36) THRAHPGDTSHRMAPTKDM4E
SCHEMBL20195751 0.92 THRA (0.37) THRAHTTHPGDTSHRMAPT
SCHEMBL9906538 0.92 TSHR (0.36) THRATHRBHTTHPGDTSHR
SCHEMBL9906533 0.92 TSHR (0.36) THRATHRBHTTHPGDTSHR
SCHEMBL9906530 0.91 TSHR (0.36) THRATHRBHPGDTSHRMAPT

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-8197710-B2 Polymerizable compound and polymerizable composition ADEKA CORPORATION (JP) 2012-06-12 US disclosed
US-20100294990-A1 POLYMERIZABLE COMPOUND AND POLYMERIZABLE COMPOSITION ADEKA CORPORATION (JP) 2010-11-25 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 (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-20100294990-A1 POLYMERIZABLE COMPOUND AND POLYMERIZABLE COMPOSITION PYM1, SCO2, ZYX THRA 1207/4885THRB 1211/4885HTT 4413/4885

“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.