SCHEMBL4794458

SCHEMBL4794458

c1ccc2c(c1)c1cc(COC3CCCCO3)ccc1n2Cc1ccc(N2CCCCC2)nc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ EP300 Q09472 1/20 0.39
▸ CREBBP Q92793 1/20 0.39
▸ KDM4C Q9H3R0 1/20 0.39
▸ CNR2 P34972 5/20 0.38
▸ ICAM1 P05362 1/20 0.36
▸ SELE P16581 1/20 0.36
▸ SMO Q99835 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ PRCP P42785 1/20 0.34
▸ TLR7 Q9NYK1 1/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ AOC3 Q16853 1/20 0.33
▸ IDO1 P14902 1/20 0.33
▸ DGAT1 O75907 1/20 0.33

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
SCHEMBL4777753 0.85 EP300 (0.41) EP300CREBBPKDM4CCNR2ICAM1
SCHEMBL4775757 0.75 PTGER4 (0.46) CNR2SMOAOC3
SCHEMBL5325246 0.69 PTGER4 (0.44) ALDH1A1HPGDSMN1; SMN2TLR7L3MBTL1
SCHEMBL14207836 0.67 MERTK (0.40) KDM4CICAM1SELEL3MBTL1
SCHEMBL2814074 0.66 TBXA2R (0.40) —
SCHEMBL11258174 0.65 KDM4C (0.46) EP300CREBBPKDM4CICAM1SELE
SCHEMBL15487276 0.65 AOC3 (0.43) KDM4CAOC3
SCHEMBL2809345 0.64 TBXA2R (0.41) —
SCHEMBL92954 0.64 NAAA (0.47) EP300CREBBPKDM4C
SCHEMBL1548491 0.64 KDM4C (0.43) KDM4CICAM1SELEALDH1A1L3MBTL1

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
WO-2007119600-A9 CARBAZOLE COMPOUND OTSUKA PHARMA CO LTD (JP) 2008-05-02 — — WO disclosed
WO-2007119600-A1 CARBAZOLE COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-10-25 — — WO disclosed
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