SCHEMBL10970098

SCHEMBL10970098

Cc1c(F)c(F)c(Oc2ccccc2[N+](=O)[O-])c(Cl)c1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ ALDH1A1 P00352 4/20 0.46
▸ TDP1 Q9NUW8 3/20 0.46
▸ HSPB1 P04792 2/20 0.44
▸ HTT P42858 3/20 0.44
▸ LMNA P02545 2/20 0.44
▸ ATM Q13315 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ NPC1 O15118 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ PIN1 Q13526 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ TTR P02766 1/20 0.40
▸ ALB P02768 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ POLB P06746 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
SCHEMBL11411623 0.83 MEN1 (0.38) HPGDL3MBTL1ALDH1A1TDP1HSPB1
SCHEMBL11401947 0.82 KDM4E (0.48) HPGDL3MBTL1ALDH1A1HTTATM
SCHEMBL10972478 0.82 MAPT (0.41) HPGDL3MBTL1ALDH1A1TDP1HSPB1
SCHEMBL11116038 0.78 TSHR (0.43) HPGDALDH1A1TDP1HSPB1MEN1
SCHEMBL11287905 0.77 ALDH1A1 (0.46) L3MBTL1ALDH1A1TDP1HSPB1HTT
SCHEMBL10766268 0.76 TDP1 (0.42) L3MBTL1ALDH1A1TDP1HSPB1HTT
SCHEMBL10947425 0.74 GPR35 (0.39) ALDH1A1TDP1HTTLMNASMN1; SMN2
SCHEMBL1338743 0.73 HSPB1 (0.60) HPGDL3MBTL1ALDH1A1TDP1HSPB1
SCHEMBL10890833 0.73 MAPT (0.37) HPGDL3MBTL1ALDH1A1TDP1HTT
SCHEMBL9120594 0.72 MEN1 (0.52) HPGDALDH1A1TDP1HTTLMNA

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
EP-0142152-A2 Novel substituted 1,2,4-triazolo- [1,5-a] pyrimidine-2-sulfonamides and compositions and methods of controlling undesired vegetation and suppressing the nitrification of ammonium nitrogen in soil THE DOW CHEMICAL COMPANY (US) 1985-05-22 — — EP disclosed
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