SCHEMBL23633147

SCHEMBL23633147

Cc1ccc2c(-c3ccc4ccccc4c3)c3ccccc3c(-c3cccc4ccccc34)c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP1A2 P05177 4/20 0.44
MAOA P21397 2/20 0.40
MAOB P27338 1/20 0.40
PIM1 P11309 2/20 0.40
CYP3A4 P08684 2/20 0.39
CYP2C9 P11712 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
DHFR P00374 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
IKBKB O14920 1/20 0.38
FLT3 P36888 1/20 0.37
ENPP3 O14638 1/20 0.37

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
SCHEMBL29865394 1.00 CYP2A6 (0.44) CYP2A6TDP1CYP1A2MAOAMAOB
SCHEMBL27955876 0.91 CYP1A2 (0.44) CYP2A6TDP1CYP1A2MAOAMAOB
SCHEMBL365629 0.89 CYP2A6 (0.55) CYP2A6TDP1CYP1A2MAOACYP3A4
SCHEMBL29353280 0.89 CYP2A6 (0.55) CYP2A6TDP1CYP1A2MAOACYP3A4
SCHEMBL15056206 0.89 CYP2A6 (0.55) CYP2A6TDP1CYP1A2MAOACYP3A4
SCHEMBL1103650 0.89 TNF (0.40) CYP2A6TDP1CYP1A2MAOAPIM1
SCHEMBL29512215 0.88 CYP2A6 (0.50) CYP2A6TDP1CYP1A2MAOAMAOB
SCHEMBL736086 0.88 CYP2A6 (0.50) CYP2A6TDP1CYP1A2MAOAMAOB
SCHEMBL536536 0.88 PIM1 (0.47) CYP2A6TDP1CYP1A2PIM1CYP2C9
SCHEMBL29350427 0.88 PIM1 (0.47) CYP2A6TDP1CYP1A2PIM1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12545650-B2 Bisanthracene derivatives having solubilizing substituent, and organic electroluminescence device using same LG CHEM, LTD. (KR) 2026-02-10 US disclosed
CN-114929667-B Bihracene derivative having solubilizing substituent and organic electroluminescent device using the same 株式会社LG化学 2024-05-28 CN disclosed
US-20230089555-A1 Bisanthracene Derivatives Having Solubilizing Substituent, and Organic Electroluminescence Device Using Same LG CHEM, LTD. (KR) 2023-03-23 US disclosed
CN-114929667-A Bisanthracene derivative having solubilizing substituent and organic electroluminescent device using the same 株式会社LG化学 2022-08-19 CN disclosed
WO-2021141428-A1 BISANTHRACENE DERIVATIVES HAVING SOLUBILIZING SUBSTITUENT, AND ORGANIC ELECTROLUMINESCENCE DEVICE USING SAME 주식회사 엘지화학 2021-07-15 WO 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-12545650-B2 Bisanthracene derivatives having solubilizing substituent, and organic electroluminescence device using same NCOR2, NCOR1, ESR2 CYP2A6 2828/4885TDP1 2287/4885CYP1A2 585/4885
US-20230089555-A1 Bisanthracene Derivatives Having Solubilizing Substituent, and Organic Electroluminescence Device Using Same TYR, MLLT1, XDH CYP2A6 1635/4885TDP1 1532/4885CYP1A2 66/4885

“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.