SCHEMBL24656883

SCHEMBL24656883

c1ccc(N(c2ccc(-c3ccc4ccc5ccc6ccccc6c5c4c3)cc2)c2cccc3c2oc2cc4ccccc4cc23)cc1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 2/20 0.33
▸ PAX8 Q06710 2/20 0.33
▸ CYP1A1 P04798 2/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ FYN P06241 1/20 0.33
▸ MAPK3 P27361 1/20 0.33
▸ AHR P35869 1/20 0.33
▸ PTPRF P10586 1/20 0.31
▸ PTPN2 P17706 1/20 0.31
▸ PTPN1 P18031 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ CYP1B1 Q16678 1/20 0.30

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
SCHEMBL24656576 0.97 CYP1A1 (0.33) ABCG2PAX8CYP1A1CYP1A2FYN
SCHEMBL24655362 0.93 CYP1A1 (0.34) ABCG2PAX8CYP1A1CYP1A2FYN
SCHEMBL24656612 0.91 ALOX5 (0.36) ABCG2PAX8CYP1A1CYP1A2FYN
SCHEMBL24655406 0.90 CYP1A1 (0.34) ABCG2PAX8CYP1A1CYP1A2FYN
SCHEMBL24655468 0.89 CYP1A1 (0.36) ABCG2PAX8CYP1A1CYP1A2FYN
SCHEMBL24655195 0.88 KDM4E (0.33) ABCG2PAX8CYP1A1CYP1A2FYN
SCHEMBL24657266 0.88 CYP1A1 (0.34) ABCG2PAX8CYP1A1CYP1A2FYN
SCHEMBL24657086 0.88 KDM4E (0.33) ABCG2PAX8CYP1A1CYP1A2FYN
SCHEMBL25902768 0.88 HSD17B1 (0.36) CYP1A1CYP1A2PTPRFPTPN2PTPN1
SCHEMBL26489495 0.87 ESR1 (0.36) CYP1A1CYP1A2AHRNPC1RAB9A

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
EP-4243100-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-09-13 — — EP disclosed
WO-2022177374-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-08-25 — — WO disclosed
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