SCHEMBL25656746

SCHEMBL25656746

C1=Cc2c(c3c4ccccc4nc(-c4cccc(-c5ccc6ccc7cc(-c8ccc9ccc%10ccc(-c%11ccccc%11)nc%10c9n8)ccc7c6c5)c4)c3c3ccccc23)CC1

nearest known ligand 0.30

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
NPY1R P25929 1/20 0.30
HTT P42858 1/20 0.30
NPY2R P49146 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL21537762 0.84 PARP1 (0.33) NPC1ALDH1A1LMNAMAPTHPGD
SCHEMBL25656596 0.82
SCHEMBL24279592 0.81 PARP1 (0.34) ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL25655840 0.81
SCHEMBL21537769 0.80 DHODH (0.34) ALDH1A1LMNAMAPTHPGD
SCHEMBL25656767 0.79
SCHEMBL21537612 0.79 PARP1 (0.35) NPC1ALDH1A1LMNAMAPTHPGD
SCHEMBL25656410 0.78
SCHEMBL21537760 0.78 PARP1 (0.35) NPC1LMNAHPGDRAB9ASMN1; SMN2
SCHEMBL21757051 0.78 ACHE (0.35) NPC1ALDH1A1LMNAMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3561892-B1 ORGANIC LIGHT-EMITTING DEVICE LT MATERIALS CO LTD (KR) 2023-05-10 EP disclosed