SCHEMBL16436409

SCHEMBL16436409

C=C(C)C(=O)OCOc1ccc(-c2ccc(-c3ccc(OC(=O)C(=C)C)cc3)o2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.43
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KMT2A Q03164 2/20 0.40
ATM Q13315 1/20 0.40
ERCC5 P28715 1/20 0.38
FEN1 P39748 1/20 0.38
NQO2 P16083 3/20 0.38
MAPT P10636 5/20 0.36
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 3/20 0.36
PKM P14618 2/20 0.36
SUCNR1 Q9BXA5 1/20 0.34
EGFR P00533 1/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2C9 P11712 2/20 0.34
HPGD P15428 2/20 0.34
CYP2C19 P33261 2/20 0.34

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
SCHEMBL16436358 0.90 THRB (0.40) ELANEPOLBAPEX1HTTTDP1
SCHEMBL16436351 0.88 POLB (0.49) ELANEPOLBAPEX1HTTTDP1
SCHEMBL16436196 0.87 ELANE (0.53) ELANEKMT2AATMERCC5FEN1
SCHEMBL16436282 0.86 ELANE (0.51) ELANEKMT2AATMERCC5FEN1
SCHEMBL16436346 0.85 ELANE (0.36) ELANEPOLBAPEX1HTTTDP1
SCHEMBL16541362 0.83 POLB (0.51) ELANEPOLBAPEX1HTTTDP1
SCHEMBL12172629 0.83 POLB (0.51) ELANEPOLBAPEX1HTTTDP1
SCHEMBL16436403 0.82 ELANE (0.46) ELANEKMT2AATMERCC5FEN1
SCHEMBL19679615 0.81 ELANE (0.53) ELANEPOLBAPEX1HTTTDP1
SCHEMBL16436429 0.81 ELANE (0.47) ELANEKMT2AATMNQO2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9315603-B2 Polymerizable compound having oxygen-containing five-membered ring, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-04-19 US disclosed
US-9315603-B2 Polymerizable compound having oxygen-containing five-membered ring, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-04-19 US disclosed
US-20150034871-A1 POLYMERIZABLE COMPOUND HAVING OXYGEN-CONTAINING FIVE-MEMBERED RING, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-02-05 US disclosed
US-20150034871-A1 POLYMERIZABLE COMPOUND HAVING OXYGEN-CONTAINING FIVE-MEMBERED RING, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-02-05 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-20150034871-A1 POLYMERIZABLE COMPOUND HAVING OXYGEN-CONTAINING FIVE-MEMBERED RING, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE OCIAD1, OCIAD2, SCO2 ELANE 2946/4885POLB 1576/4885APEX1 797/4885

“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.