SCHEMBL9967346

SCHEMBL9967346

O=C(Oc1cc(OC(=O)c2cc(O)cc(O)c2)cc(OC(=O)c2cc(O)cc(O)c2)c1)c1cc(O)cc(O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.58
CA1 P00915 4/20 0.58
CA2 P00918 4/20 0.58
CA7 P43166 4/20 0.58
CA9 Q16790 4/20 0.58
CA14 Q9ULX7 4/20 0.58
NSD2 O96028 1/20 0.47
CA5A P35218 1/20 0.46
FASN P49327 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ESR1 P03372 2/20 0.41
ESR2 Q92731 2/20 0.41
HSD17B10 Q99714 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41

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
SCHEMBL1716169 0.88 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL618766 0.86 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL10785180 0.85 CA12 (0.52) CA12CA1CA2CA7CA9
SCHEMBL14456167 0.84 PRSS1 (0.51) CA12CA1CA2CA7CA9
SCHEMBL14456126 0.84 PRSS1 (0.51) CA12CA1CA2CA7CA9
SCHEMBL3009866 0.83 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL21465837 0.83 CA12 (0.58) CA12CA1CA2CA7CA9
SCHEMBL10960406 0.83 NSD2 (0.70) CA12CA1CA2CA7CA9
SCHEMBL11191457 0.80 NSD2 (0.52) CA12CA1CA2CA7CA9
SCHEMBL8205792 0.80 CA12 (0.52) CA12CA1CA2CA7CA9

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-20120156614-A1 Novel Phenol Compounds and Positive Photosensitive Resin Composition Including the Same SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-06-21 US disclosed
US-20120156614-A1 Novel Phenol Compounds and Positive Photosensitive Resin Composition Including the Same SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-06-21 US disclosed
US-7247261-B2 Nonlinear optical material with nano-sized dendrimer structure ELECTRONICS AND TELECOMMUNICATIONS RESEARCH INSTITUTE (KR) 2007-07-24 US disclosed
US-7247261-B2 Nonlinear optical material with nano-sized dendrimer structure ELECTRONICS AND TELECOMMUNICATIONS RESEARCH INSTITUTE (KR) 2007-07-24 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-20120156614-A1 Novel Phenol Compounds and Positive Photosensitive Resin Composition Including the Same SUN2, TYR, PSMD2 CA12 3524/4885CA1 4119/4885CA2 2469/4885

“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.