SCHEMBL16984664

SCHEMBL16984664

c1ccc2c(c1)ccc1c3ccc4c5ccccc5oc4c3oc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
KMT2A Q03164 1/20 0.46
HPRT1 P00492 1/20 0.44
KDM4E B2RXH2 4/20 0.44
HPGD P15428 4/20 0.44
ALDH1A1 P00352 4/20 0.44
CYP1A1 P04798 4/20 0.44
CYP1B1 Q16678 4/20 0.44
HSD17B10 Q99714 3/20 0.44
CYP1A2 P05177 3/20 0.44
MAPT P10636 3/20 0.44
ABCG2 Q9UNQ0 3/20 0.44
HTT P42858 2/20 0.44
TSHR P16473 2/20 0.44
ABCC1 P33527 2/20 0.44
ALOX15 P16050 1/20 0.44
PDE5A O76074 1/20 0.44
TP53 P04637 1/20 0.44
ABCB1 P08183 1/20 0.44

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
SCHEMBL29352523 0.96 L3MBTL1 (0.52) L3MBTL1TDP1KMT2AHPRT1KDM4E
SCHEMBL5470929 0.96 L3MBTL1 (0.52) L3MBTL1TDP1KMT2AHPRT1KDM4E
SCHEMBL21331560 0.90 HPRT1 (0.58) L3MBTL1TDP1KMT2AHPRT1KDM4E
SCHEMBL15443237 0.89 L3MBTL1 (0.46) L3MBTL1TDP1KMT2AHPRT1KDM4E
SCHEMBL5470220 0.87 HPRT1 (0.57) L3MBTL1TDP1KMT2AHPRT1KDM4E
SCHEMBL30154375 0.87 HPRT1 (0.57) L3MBTL1TDP1KMT2AHPRT1KDM4E
SCHEMBL1635471 0.85 AHR (0.52) KMT2AKDM4EHPGDALDH1A1HSD17B10
SCHEMBL13564032 0.85 AHR (0.52) KMT2AKDM4EHPGDALDH1A1HSD17B10
SCHEMBL11914250 0.85 L3MBTL1 (0.54) L3MBTL1TDP1KMT2AHPRT1KDM4E
SCHEMBL31705606 0.82 L3MBTL1 (0.56) L3MBTL1TDP1KMT2AHPRT1KDM4E

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-20150221876-A1 ORGANIC THIN FILM TRANSISTOR, ORGANIC SEMICONDUCTOR THIN FILM, AND ORGANIC SEMICONDUCTOR MATERIAL FUJIFILM CORPORATION (JP) 2015-08-06 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-20150221876-A1 ORGANIC THIN FILM TRANSISTOR, ORGANIC SEMICONDUCTOR THIN FILM, AND ORGANIC SEMICONDUCTOR MATERIAL OR10J3, POF1B, SLC43A1 L3MBTL1 227/4885TDP1 1300/4885KMT2A 1153/4885

“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.