SCHEMBL20733799

SCHEMBL20733799

c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2c2nc(-c4ccc5c6ccccc6c6ccccc6c5c4)nnc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CYP1A2 P05177 2/20 0.39
▸ HIF1A Q16665 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ DHFR P00374 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ ESR1 P03372 2/20 0.36
▸ ESR2 Q92731 2/20 0.36
▸ BACE1 P56817 1/20 0.36
▸ GP6 Q9HCN6 1/20 0.36
▸ JAK2 O60674 2/20 0.35

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
SCHEMBL20733715 0.93 NPC1 (0.43) ALDH1A1MAPTDHFRNPC1MAPK1
SCHEMBL20733721 0.89 GP6 (0.40) ALDH1A1L3MBTL1MAPTDHFRNPC1
SCHEMBL20733712 0.86 MEN1 (0.40) ALDH1A1L3MBTL1MAPTDHFRNPC1
SCHEMBL20733736 0.86 ALDH1A1 (0.37) ALDH1A1L3MBTL1CYP1A2HIF1ACYP3A4
SCHEMBL20733790 0.84 ALDH1A1 (0.41) ALDH1A1L3MBTL1CYP1A2HIF1ACYP3A4
SCHEMBL20733789 0.84 ALDH1A1 (0.41) ALDH1A1L3MBTL1CYP1A2HIF1ACYP3A4
SCHEMBL20733802 0.83 L3MBTL1 (0.39) ALDH1A1L3MBTL1CYP1A2HIF1ACYP3A4
SCHEMBL24169643 0.79 MEN1 (0.48) ALDH1A1L3MBTL1MAPTDHFRJAK2
SCHEMBL16641427 0.79 MEN1 (0.48) ALDH1A1L3MBTL1MAPTDHFRJAK2
SCHEMBL20721644 0.79 ALDH1A1 (0.39) ALDH1A1L3MBTL1CYP1A2MAPTDHFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230057590-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2023-02-23 — — US disclosed
US-20190051842-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2019-02-14 — — 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-20230057590-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, OXER1 ALDH1A1 1010/4885L3MBTL1 803/4885CYP1A2 869/4885
US-20190051842-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, OXER1 ALDH1A1 1010/4885L3MBTL1 803/4885CYP1A2 869/4885

“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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