SCHEMBL347683

SCHEMBL347683

CCCCCCCCOc1ccc2cc(OCCCCCCCC)ccc2c1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.62
TSHR P16473 2/20 0.59
THRA P10827 1/20 0.57
LTA4H P09960 3/20 0.55
TP53 P04637 1/20 0.55
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA3 P07451 1/20 0.54
CA4 P22748 1/20 0.54
CA6 P23280 1/20 0.54
CA7 P43166 1/20 0.54
CA9 Q16790 1/20 0.54
CA14 Q9ULX7 1/20 0.54
CA5B Q9Y2D0 1/20 0.54
PLA2G4B P0C869 1/20 0.53

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
SCHEMBL4945033 1.00 NR5A1 (0.62) NR5A1TSHRTHRALTA4HTP53
SCHEMBL10642885 1.00 NR5A1 (0.62) NR5A1TSHRTHRALTA4HTP53
SCHEMBL17018215 0.96 NR5A1 (0.58) NR5A1TSHRTHRALTA4HTP53
SCHEMBL30426140 0.96 NR5A1 (0.58) NR5A1TSHRTHRALTA4HTP53
SCHEMBL17162145 0.96 NR5A1 (0.58) NR5A1TSHRTHRALTA4HTP53
SCHEMBL19809314 0.93 CA12 (0.59) NR5A1THRALTA4HCA12CA1
SCHEMBL29779708 0.93 CA12 (0.59) NR5A1THRALTA4HCA12CA1
SCHEMBL11077065 0.92 KDM4E (0.61) NR5A1TSHRLTA4H
SCHEMBL15762830 0.92 NR5A1 (0.55) NR5A1TSHRTHRALTA4HTP53
SCHEMBL5374714 0.92 KDM4E (0.61) NR5A1TSHRLTA4H

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-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-19 US disclosed
US-8048982-B2 Method for producing aromatic compound polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-01 US disclosed
EP-2241548-A1 Vanadium di-nuclear complex Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
EP-2241547-A1 Method for producing aromatic compound polymer Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
US-20090018309-A1 Method for Producing Aromatic Compound Polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-15 US disclosed
EP-1767560-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER Sumitomo Chemical Company, Limited (JP) 2007-03-28 EP 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 (2 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-20090018309-A1 Method for Producing Aromatic Compound Polymer PAH, MAOA, AHR NR5A1 1330/4885TSHR 3657/4885THRA 2080/4885
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER PAH, MAOA, AHR NR5A1 1291/4885TSHR 3727/4885THRA 2206/4885

“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.