SCHEMBL30434283

SCHEMBL30434283

CCCCCCCCCOc1c2ccc(C)cc2c(OCCCCCCCCC)c2ccc(C)cc12

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 4/20 0.42
▸ GAA P10253 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ NR5A1 Q13285 1/20 0.41
▸ TSHR P16473 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ THRA P10827 3/20 0.39
▸ PLK1 P53350 3/20 0.39
▸ LMNA P02545 1/20 0.38
▸ KCNA3 P22001 1/20 0.37
▸ KCNA5 P22460 1/20 0.37
▸ TLR4 O00206 2/20 0.37
▸ PLA2G2A P14555 1/20 0.37
▸ TP53 P04637 1/20 0.37

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
SCHEMBL18644163 1.00 THRB (0.42) THRBGAAALDH1A1MAPTNPSR1
SCHEMBL30434063 1.00 THRB (0.42) THRBGAAALDH1A1MAPTNPSR1
SCHEMBL30434155 1.00 THRB (0.42) THRBGAAALDH1A1MAPTNPSR1
SCHEMBL20398582 0.95 FAAH (0.43) THRBGAAALDH1A1MAPTNPSR1
SCHEMBL20398595 0.95 FAAH (0.43) THRBGAAALDH1A1MAPTNPSR1
SCHEMBL20398633 0.95 FAAH (0.43) THRBGAAALDH1A1MAPTNPSR1
SCHEMBL20398492 0.95 FAAH (0.43) THRBGAAALDH1A1MAPTNPSR1
SCHEMBL20398529 0.95 FAAH (0.43) THRBGAAALDH1A1MAPTNPSR1
SCHEMBL20398701 0.93 PGR (0.41) THRBGAAALDH1A1MAPTNPSR1
SCHEMBL20398502 0.88 CYP1A2 (0.43) GAAALDH1A1MAPTNPSR1KDM4E

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
CN-111492498-B Organic electronic device 株式会社LG化学 2023-05-30 — — CN disclosed
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