SCHEMBL14727688

SCHEMBL14727688

C=C(C)C(=O)O/C=C/C=C/C=C/Oc1ccc(C2(c3ccc(OC(=O)C(=C)C)cc3)CCCCC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.40
KMT2A Q03164 3/20 0.38
ATM Q13315 1/20 0.38
ELANE P08246 1/20 0.37
PSMB1 P20618 1/20 0.33
PSMB5 P28074 1/20 0.33
PSMB2 P49721 1/20 0.33
ESR1 P03372 2/20 0.33
ESR2 Q92731 2/20 0.33
PPARA Q07869 1/20 0.31
NFKB1 P19838 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL2703811 0.84 KMT2A (0.49) ADORA3KMT2AATMELANEPSMB1
SCHEMBL14727689 0.82 HPGD (0.33) ADORA3KMT2AATMELANE
SCHEMBL14727692 0.82 KMT2A (0.32) KMT2AATMELANE
SCHEMBL7219066 0.77 THRB (0.47) ADORA3KMT2AATMELANEPSMB1
SCHEMBL14984641 0.76 ELANE (0.51) KMT2AATMELANEPPARANFKB1
SCHEMBL7218282 0.75 THRB (0.48) ADORA3KMT2AATMELANEMEN1
SCHEMBL12755204 0.74 ADORA3 (0.43) ADORA3KMT2AATMELANEPSMB1
SCHEMBL10886240 0.74 ADORA3 (0.44) ADORA3KMT2AATMELANEPSMB1
SCHEMBL12755181 0.74 ADORA3 (0.42) ADORA3KMT2AATMELANEPSMB1
SCHEMBL9915743 0.74 ADORA3 (0.42) ADORA3KMT2AATMELANEPSMB1

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-8840807-B2 Polymerizable compound JNC CORPORATION (JP) 2014-09-23 US disclosed
US-20130048912-A1 POLYMERIZABLE COMPOUND JNC PETROCHEMICAL CORPORATION (JP) 2013-02-28 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-20130048912-A1 POLYMERIZABLE COMPOUND PYM1, ZYX, CPNE4 ADORA3 1810/4885KMT2A 617/4885ATM 2670/4885

“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.