SCHEMBL25933291

SCHEMBL25933291

Clc1cc(-c2ccccc2)c(-c2cccc3c2ccc2ccccc23)c(-c2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 3/20 0.47
LMNA P02545 2/20 0.41
MAPK1 P28482 2/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
APEX1 P27695 1/20 0.41
PMP22 Q01453 1/20 0.41
ALDH1A1 P00352 3/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP2A6 P11509 1/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
SOS1 Q07889 1/20 0.40
PAX8 Q06710 1/20 0.40
TNF P01375 1/20 0.40
CYP1B1 Q16678 5/20 0.40
CYP1A2 P05177 4/20 0.40
CYP1A1 P04798 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40

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
SCHEMBL25932620 0.84 GPR84 (0.47) MAPK1MAPTALDH1A1HSD17B10CYP2A6
SCHEMBL25403876 0.84 HPRT1 (0.52) HPRT1LMNAMAPK1MAPTALDH1A1
SCHEMBL25933073 0.83 CYP1B1 (0.44) HPRT1CYP3A4MAPTALDH1A1HSD17B10
SCHEMBL25240721 0.83 HPRT1 (0.50) HPRT1LMNAMAPK1MAPTALDH1A1
SCHEMBL25211425 0.82 SOS1 (0.46) HPRT1LMNAMAPK1MAPTALDH1A1
SCHEMBL29878817 0.82 HPRT1 (0.45) HPRT1LMNAMAPK1CYP3A4MAPT
SCHEMBL27631995 0.82 HPRT1 (0.64) HPRT1LMNAMAPK1MAPTALDH1A1
SCHEMBL443518 0.82 HPRT1 (0.64) HPRT1LMNAMAPK1MAPTALDH1A1
SCHEMBL25215764 0.81 ALDH1A1 (0.47) HPRT1MAPK1ALDH1A1HSD17B10TSHR
SCHEMBL25932873 0.81 ALDH1A1 (0.45) HPRT1LMNAMAPTALDH1A1HSD17B10

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
WO-2023146344-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-08-03 WO disclosed