SCHEMBL24368958

SCHEMBL24368958

c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cc5cc6ccccc6cc5s4)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 4/20 0.47
▸ ESR2 Q92731 4/20 0.47
▸ APP P05067 3/20 0.45
▸ HSD17B1 P14061 1/20 0.41
▸ HSD17B2 P37059 1/20 0.41
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ ERN1 O75460 1/20 0.35
▸ F9 P00740 2/20 0.34
▸ CYP1A1 P04798 1/20 0.34
▸ CYP1B1 Q16678 1/20 0.34
▸ NPC1 O15118 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ PI4KA P42356 1/20 0.33
▸ PI4KB Q9UBF8 1/20 0.33

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
SCHEMBL24368555 1.00 ESR1 (0.47) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL24369001 1.00 ESR1 (0.47) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL24369006 1.00 ESR1 (0.47) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL24369003 0.95 APP (0.49) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL24369005 0.94 ESR1 (0.47) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL24368563 0.94 ESR1 (0.47) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL24368554 0.91 APP (0.43) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL18590870 0.90 ESR1 (0.49) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL24368438 0.87 APP (0.60) ESR1ESR2APPHSD17B1HSD17B2
SCHEMBL24368462 0.87 APP (0.60) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220127277-A1 ORGANIC COMPOUND FOR CAPPING LAYER AND ORGANIC LIGHT EMITTING DIODE COMPRISING THE SAME DONGJIN SEMICHEM CO., LTD. (KR) 2022-04-28 — — 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-20220127277-A1 ORGANIC COMPOUND FOR CAPPING LAYER AND ORGANIC LIGHT EMITTING DIODE COMPRISING THE SAME CAPG, CAPZA1, OCIAD1 ESR1 2033/4885ESR2 2183/4885APP 3924/4885

“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.

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