SCHEMBL21166599

SCHEMBL21166599

c1ccc(-c2cc3cc4sc5cc6cc(-c7ccccc7)sc6cc5c4cc3s2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.56
ESR2 Q92731 4/20 0.56
APP P05067 2/20 0.44
HSD17B1 P14061 2/20 0.44
HSD17B2 P37059 2/20 0.44
RAB9A P51151 4/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
PPARG P37231 1/20 0.39
NCOA2 Q15596 1/20 0.39
NCOA1 Q15788 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1B1 Q16678 1/20 0.39
ALDH1A1 P00352 4/20 0.38
HPGD P15428 2/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL21166680 0.92 ESR1 (0.56) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL17356258 0.92 ESR1 (0.49) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL2150417 0.90 ESR1 (0.66) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL25451947 0.89 ESR1 (0.53) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL17086853 0.89 ESR1 (0.50) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL17356246 0.87 ESR1 (0.47) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL17356244 0.87 ESR1 (0.47) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL20804575 0.86 ESR1 (0.61) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL12562738 0.86 ESR1 (0.61) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL2368401 0.86 ESR1 (0.61) ESR1ESR2APPHSD17B1HSD17B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10985327-B2 Microcrystalline organic semiconductor film, organic semiconductor transistor, and method of manufacturing organic semiconductor transistor FUJIFILM CORPORATION (JP) 2021-04-20 US disclosed
US-20190237677-A1 MICROCRYSTALLINE ORGANIC SEMICONDUCTOR FILM, ORGANIC SEMICONDUCTOR TRANSISTOR, AND METHOD OF MANUFACTURING ORGANIC SEMICONDUCTOR TRANSISTOR FUJIFILM CORPORATION (JP) 2019-08-01 US disclosed
US-20190221754-A1 BOTTOM GATE TYPE ORGANIC SEMICONDUCTOR TRANSISTOR FUJIFILM CORPORATION (JP) 2019-07-18 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 (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-20190237677-A1 MICROCRYSTALLINE ORGANIC SEMICONDUCTOR FILM, ORGANIC SEMICONDUCTOR TRANSISTOR, AND METHOD OF MANUFACTURING ORGANIC SEMICONDUCTOR TRANSISTOR OR10J3, ALK, MSMO1 ESR1 3934/4885ESR2 3988/4885APP 867/4885
US-10985327-B2 Microcrystalline organic semiconductor film, organic semiconductor transistor, and method of manufacturing organic semiconductor transistor OR10J3, ALK, MSMO1 ESR1 3934/4885ESR2 3988/4885APP 867/4885

“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.