SCHEMBL27277199

SCHEMBL27277199

Clc1ccc(-c2ccc3c(c2)Oc2ccccc2O3)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 6/20 0.53
▸ NPC1 O15118 2/20 0.44
▸ TP53 P04637 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ MAPK1 P28482 1/20 0.43
▸ GRM2 Q14416 1/20 0.42
▸ SRD5A2 P31213 1/20 0.41
▸ EDNRB P24530 1/20 0.39
▸ EDNRA P25101 1/20 0.39
▸ HSD11B1 P28845 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39

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
SCHEMBL27277655 0.92 AHR (0.49) AHRNPC1TP53RAB9ASMN1; SMN2
SCHEMBL25818508 0.83 AHR (0.50) AHRTP53SMN1; SMN2ALDH1A1TSHR
SCHEMBL27277506 0.83 MAPK1 (0.44) AHRNPC1TP53RAB9AHPGD
SCHEMBL27277425 0.83 AHR (0.59) AHRSMN1; SMN2
SCHEMBL1690731 0.79 AHR (0.85) AHRTP53SMN1; SMN2ALDH1A1TSHR
SCHEMBL17165565 0.77 RAB9A (0.50) AHRNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL16863586 0.77 AHR (0.54) AHRNPC1TP53RAB9ASMN1; SMN2
SCHEMBL27277431 0.75 MEN1 (0.44) NPC1TP53RAB9ASMN1; SMN2ALDH1A1
SCHEMBL19058260 0.75 SLC6A3 (0.56) NPC1TP53RAB9ASMN1; SMN2ALDH1A1
SCHEMBL27277427 0.74 LIPG (0.47) AHR

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-2024101948-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2024-05-16 — — WO disclosed
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