SCHEMBL27793303

SCHEMBL27793303

O=[N+]([O-])C(Br)=Cc1ccc(Br)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FBP1 P09467 11/20 0.70
▸ ALOX5 P09917 1/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ JAK2 O60674 1/20 0.40
▸ MITF O75030 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ NTSR1 P30989 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ PRMT1 Q99873 1/20 0.39
▸ S1PR4 O95977 1/20 0.39
▸ S1PR1 P21453 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ AKR1C3 P42330 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
SCHEMBL8856360 0.82 FBP1 (0.68) FBP1MAPTALDH1A1
SCHEMBL8856279 0.82 FBP1 (0.68) FBP1MEN1LMNAMAPTKMT2A
SCHEMBL8856283 0.82 FBP1 (0.68) FBP1MEN1LMNAMAPTKMT2A
SCHEMBL8856223 0.82 FBP1 (0.68) FBP1
SCHEMBL8856356 0.82 FBP1 (0.68) FBP1MAPTALDH1A1
SCHEMBL8856230 0.82 FBP1 (0.68) FBP1
SCHEMBL2820854 0.82 FBP1 (1.00) FBP1MEN1KMT2AALDH1A1PRMT1
SCHEMBL205355 0.82 FBP1 (1.00) FBP1MEN1KMT2AALDH1A1PRMT1
SCHEMBL26976895 0.82 FBP1 (0.47) FBP1ALOX5MEN1LMNAMAPT
SCHEMBL205356 0.82 FBP1 (1.00) FBP1MEN1KMT2AALDH1A1PRMT1

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-101845048-A Synthetic method of 2-nitro-2,3-dihydrofuran derivative UNIV ZHEJIANG NORMAL 2010-09-29 — — CN disclosed
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