SCHEMBL24315343

SCHEMBL24315343

N=C(/N=C(\N)c1cccc2oc3cc(Cl)ccc3c12)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.43
TTR P02766 3/20 0.37
GRIN2B Q13224 1/20 0.35
HTR2B P41595 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
MAPT P10636 3/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 2/20 0.33
S100B P04271 1/20 0.33
GFER P55789 1/20 0.33
MCL1 Q07820 1/20 0.33
ALDH1A1 P00352 1/20 0.32
GLA P06280 1/20 0.32

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
SCHEMBL25654470 0.89 AHR (0.51) AHRTTRGRIN2BHTR2BCA1
SCHEMBL24907678 0.86 ALDH1A1 (0.43) TTRHTR2BMAPTRAB9ASMN1; SMN2
SCHEMBL24655499 0.86 PRSS1 (0.40) HTR2BMAPTALDH1A1GLA
SCHEMBL23820566 0.84 AHR (0.38) AHRTTRHTR2BCA1CA2
SCHEMBL25654459 0.84 HTR2B (0.36) TTRHTR2BMAPTHPGDKMT2A
SCHEMBL22992123 0.83 MAPT (0.38) HTR2BMAPTRAB9ANPC1HPGD
SCHEMBL22916346 0.82 PRKAB2 (0.33) AHRTTRHTR2BMAPTRAB9A
SCHEMBL24656629 0.81 ERBB2 (0.35) AHRHTR2BMAPTRAB9ANPC1
SCHEMBL22916636 0.81 PRKAB2 (0.35) AHRTTRMAPT
SCHEMBL26064331 0.80 AHR (0.41) AHRTTRMAPTRAB9ASMN1; 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-4235829-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-08-30 EP disclosed
EP-3972001-A1 ORGANIC LIGHT EMITTING DEVICE LG Chem, Ltd. (KR) 2022-03-23 EP disclosed