SCHEMBL24657633

SCHEMBL24657633

c1ccc2c(c1)ccc1ccc3cc(N(c4ccc5c(c4)sc4ccccc45)c4ccc5c(c4)sc4ccccc45)ccc3c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.42
▸ HPGD P15428 3/20 0.42
▸ MAPT P10636 3/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NQO2 P16083 2/20 0.41
▸ NQO1 P15559 1/20 0.41
▸ GPR3 P46089 1/20 0.41
▸ CYP1A2 P05177 3/20 0.37
▸ ERBB2 P04626 1/20 0.37
▸ FYN P06241 1/20 0.37
▸ MAOA P21397 1/20 0.37
▸ ACHE P22303 1/20 0.37
▸ AHR P35869 1/20 0.37
▸ HSD17B10 Q99714 4/20 0.35
▸ HIF1A Q16665 2/20 0.35
▸ CYP1B1 Q16678 1/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ HPRT1 P00492 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
SCHEMBL24657792 0.96 ALDH1A1 (0.40) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL24657643 0.96 MAPT (0.40) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL24657635 0.93 NQO2 (0.40) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL24657462 0.92 ALDH1A1 (0.37) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL24657708 0.92 MAPT (0.41) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL26057052 0.91 ALDH1A1 (0.45) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL24657478 0.91 ALDH1A1 (0.38) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL24657051 0.90 ALDH1A1 (0.35) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL24657791 0.89 NQO2 (0.38) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL24657637 0.89 L3MBTL1 (0.37) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2

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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