SCHEMBL29706586

SCHEMBL29706586

OB(O)Oc1ccc(-c2cccc(Br)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.42
▸ GABRG2 P18507 3/20 0.39
▸ GABRB3 P28472 3/20 0.39
▸ GABRA5 P31644 3/20 0.39
▸ GABRA3 P34903 3/20 0.39
▸ TDP2 O95551 1/20 0.39
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ NPC1 O15118 4/20 0.39
▸ RAB9A P51151 4/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ TP53 P04637 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ ALOX12 P18054 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
SCHEMBL29706426 0.87 GABRG2 (0.40) MCL1GABRG2GABRB3GABRA5GABRA3
SCHEMBL1992410 0.80 CA1 (0.50) MEN1KMT2AALDH1A1CYP1A2MAPK1
SCHEMBL29706415 0.80 MAPK1 (0.44) MCL1MEN1KMT2ARAB9AALDH1A1
SCHEMBL13682551 0.79 ALDH1A1 (0.52) GABRG2GABRB3GABRA5GABRA3TDP2
SCHEMBL1973121 0.79 ESR2 (0.39) NPC1RAB9ACYP1A2TP53MAPK1
SCHEMBL30462553 0.79 MGLL (0.45) MCL1ALDH1A1CYP1A2MAPK1ABL1
SCHEMBL760366 0.78 MAOB (0.47) KMT2ARAB9AALDH1A1CYP1A2TSHR
SCHEMBL38660021 0.78 MAOB (0.47) KMT2ARAB9AALDH1A1CYP1A2TSHR
SCHEMBL23581115 0.77 MGLL (0.59) GABRG2GABRB3GABRA5GABRA3TDP2
SCHEMBL1181012 0.77 ABL1 (0.63) GABRG2GABRB3GABRA5GABRA3MEN1

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-11611045-B2 Organic compound, electronic component containing organic compound, and electronic device SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-03-21 — — US disclosed
US-20220223796-A1 ORGANIC COMPOUND, ELECTRONIC COMPONENT CONTAINING ORGANIC COMPOUND, AND ELECTRONIC DEVICE SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2022-07-14 — — 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-11611045-B2 Organic compound, electronic component containing organic compound, and electronic device EXOC1, EXOC4, CHRM1 MCL1 2384/4885GABRG2 3324/4885GABRB3 2677/4885
US-20220223796-A1 ORGANIC COMPOUND, ELECTRONIC COMPONENT CONTAINING ORGANIC COMPOUND, AND ELECTRONIC DEVICE EXOC1, EXOC4, CHRM1 MCL1 2384/4885GABRG2 3324/4885GABRB3 2677/4885

“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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