SCHEMBL20175791

SCHEMBL20175791

OB(O)c1ccc2c(c1)-c1c(ccc3ccccc13)C21c2ccccc2-c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
DNMT1 P26358 1/20 0.33
NSD2 O96028 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
HKDC1 Q2TB90 1/20 0.33
SOS1 Q07889 1/20 0.33
DHFR P00374 2/20 0.32
TYMS P04818 2/20 0.32
WDR5 P61964 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
ENPP2 Q13822 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HIF1A Q16665 1/20 0.30
CYP1B1 Q16678 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
SCHEMBL30506451 0.92 CA1 (0.41) CA1CA2DNMT1NSD2OPRM1
SCHEMBL19511253 0.92 CA1 (0.41) CA1CA2DNMT1NSD2OPRM1
SCHEMBL19980595 0.92 CA1 (0.41) CA1CA2DNMT1NSD2OPRM1
SCHEMBL29473425 0.82 DNMT1 (0.43) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL14681416 0.82 CA1 (0.44) CA1CA2ESR1ESR2ENPP2
SCHEMBL29364815 0.82 CA1 (0.44) CA1CA2ESR1ESR2ENPP2
SCHEMBL19974142 0.82 DNMT1 (0.43) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL23258810 0.82 CA1 (0.45) CA1CA2DNMT1NSD2OPRM1
SCHEMBL20393960 0.81 MEN1 (0.36) CA1CA2DNMT1NSD2OPRM1
SCHEMBL20914937 0.80 DNMT1 (0.44) DNMT1NSD2OPRM1OPRD1HKDC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180141957-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2018-05-24 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-20180141957-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF PIEZO1, OCIAD1, LEF1 CA1 1041/4885CA2 1260/4885DNMT1 245/4885

“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.