SCHEMBL10719634

SCHEMBL10719634

O=[N+]([O-])c1cccc(C2=CC3=CC4=NC(=CC5=NC(=CC6=NC(=CC2=N3)C=C6)C=C5)C=C4)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPRC P08575 1/20 0.42
▸ MAPT P10636 5/20 0.40
▸ PSMB8 P28062 1/20 0.40
▸ RAB9A P51151 4/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 4/20 0.39
▸ TSHR P16473 1/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.38
▸ MGAM O43451 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ SI P14410 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ MGAM2 Q2M2H8 1/20 0.38
▸ CYP1A2 P05177 1/20 0.36
▸ PGR P06401 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ HTT P42858 1/20 0.36

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
SCHEMBL9091732 0.84 MAPT (0.38) MAPTRAB9ANPC1ALDH1A1LMNA
SCHEMBL8186752 0.80 LMNA (0.38) PTPRCMAPTPSMB8RAB9ASMN1; SMN2
SCHEMBL3107258 0.78 HSD17B1 (0.38) CYP1A2
SCHEMBL28327044 0.78 IDO1 (0.33) RAB9ASMN1; SMN2NPC1ALDH1A1TSHR
SCHEMBL28318813 0.77 GPR35 (0.36) PTPRCMAPTALDH1A1TSHRTDP1
SCHEMBL28187477 0.75 MAOA (0.31) —
SCHEMBL28306376 0.75 MAOA (0.31) —
SCHEMBL1275382 0.75 MAOA (0.31) —
SCHEMBL28146959 0.75 MAOA (0.31) —
SCHEMBL27718352 0.75 TSHR (0.35) SMN1; SMN2ALDH1A1TSHRTDP1

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
JP-62067086-A — — None — — JP disclosed
JP-S6267086-A NOVEL TETRAPHENYLPORPHYRIN DERIVATIVE WAKO PURE CHEM IND LTD 1987-03-26 — — JP disclosed
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