SCHEMBL8507853

SCHEMBL8507853

COC(=Cc1ccccc1)[N+](=O)[O-]

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FBP1 P09467 4/20 0.59
▸ PRMT1 Q99873 1/20 0.53
▸ MAPT P10636 2/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ CMA1 P23946 1/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ AKR1C3 P42330 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ RECQL P46063 1/20 0.40

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
SCHEMBL2343853 0.85 FBP1 (0.58) FBP1PRMT1MEN1KMT2AALDH1A1
SCHEMBL11224683 0.81 FBP1 (0.59) FBP1PRMT1MAPTNPSR1MEN1
SCHEMBL12122140 0.77 SMN1; SMN2 (0.63) FBP1PRMT1MAPTNPSR1SMN1; SMN2
SCHEMBL15234446 0.77 FBP1 (0.54) FBP1PRMT1MAPTMEN1KMT2A
SCHEMBL27704199 0.77 SMN1; SMN2 (0.63) FBP1PRMT1MAPTNPSR1SMN1; SMN2
SCHEMBL27947569 0.76 LMNA (0.51) FBP1PRMT1MEN1KMT2ATDP1
SCHEMBL1749791 0.75 FBP1 (1.00) FBP1PRMT1MAPTNPSR1SMN1; SMN2
SCHEMBL1127238 0.75 FBP1 (1.00) FBP1PRMT1MAPTNPSR1SMN1; SMN2
SCHEMBL1032131 0.75 FBP1 (1.00) FBP1PRMT1MAPTNPSR1SMN1; SMN2
SCHEMBL9328703 0.74 FBP1 (0.64) FBP1PRMT1ALDH1A1TSHRAKR1C3

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-0923581-A1 4-SUBSTITUTED BETA-CARBOLINES AS IMMUNOMODULATORS BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 1999-06-23 — — EP disclosed
WO-1998006719-A1 4-SUBSTITUTED BETA-CARBOLINES AS IMMUNOMODULATORS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 1998-02-19 — — WO disclosed
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