SCHEMBL24657643

SCHEMBL24657643

c1ccc2c(c1)ccc1ccc3cc(N(c4ccc5c(c4)sc4ccccc45)c4ccc5sc6ccccc6c5c4)ccc3c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ HPGD P15428 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ NQO2 P16083 2/20 0.39
▸ NQO1 P15559 1/20 0.39
▸ GPR3 P46089 1/20 0.38
▸ CYP1A2 P05177 2/20 0.35
▸ MAOA P21397 2/20 0.34
▸ ERBB2 P04626 1/20 0.34
▸ FYN P06241 1/20 0.34
▸ ACHE P22303 1/20 0.34
▸ AHR P35869 1/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ HIF1A Q16665 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ CYP1B1 Q16678 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
SCHEMBL24657635 0.97 NQO2 (0.40) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL24657708 0.96 MAPT (0.41) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL24657633 0.96 ALDH1A1 (0.42) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL24657791 0.93 NQO2 (0.38) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL24657792 0.92 ALDH1A1 (0.40) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL26057053 0.92 ALDH1A1 (0.41) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL24657465 0.91 MAPT (0.35) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL25886299 0.90 MAPT (0.41) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL25884098 0.90 MAPT (0.41) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL24657045 0.90 NQO2 (0.36) MAPTALDH1A1HPGDRAB9ASMN1; 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
Send feedback