SCHEMBL10766268

SCHEMBL10766268

Cc1c(F)c(F)c(Oc2ccc([N+](=O)[O-])c(F)c2)c(Cl)c1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 4/20 0.42
▸ ATM Q13315 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.36
▸ HTT P42858 2/20 0.36
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ TTR P02766 2/20 0.36
▸ ALB P02768 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ PDE7A Q13946 1/20 0.36
▸ MAPT P10636 4/20 0.35
▸ LMNA P02545 2/20 0.35
▸ MERTK Q12866 1/20 0.35
▸ POLB P06746 2/20 0.34
▸ MITF O75030 1/20 0.34
▸ CCR6 P51684 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ HSPB1 P04792 2/20 0.34
▸ PPOX P50336 1/20 0.34

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
SCHEMBL11287905 0.91 ALDH1A1 (0.46) TDP1ALDH1A1HTTMEN1KMT2A
SCHEMBL11411623 0.89 MEN1 (0.38) TDP1ALDH1A1HTTMEN1KMT2A
SCHEMBL10947425 0.88 GPR35 (0.39) TDP1ALDH1A1HTTMEN1KMT2A
SCHEMBL10890833 0.85 MAPT (0.37) TDP1ALDH1A1HTTMEN1KMT2A
SCHEMBL9120594 0.84 MEN1 (0.52) TDP1ALDH1A1HTTMEN1KMT2A
SCHEMBL11190333 0.84 TDP1 (0.43) TDP1ALDH1A1HTTMEN1KMT2A
SCHEMBL10430085 0.83 TDP1 (0.43) TDP1ALDH1A1HTTMEN1KMT2A
SCHEMBL11295140 0.83 ALDH1A1 (0.33) TDP1ALDH1A1HTTMEN1KMT2A
SCHEMBL11213666 0.83 TDP1 (0.57) TDP1ALDH1A1HTTMEN1KMT2A
SCHEMBL10608335 0.83 KMT2A (0.36) TDP1ALDH1A1HTTMEN1KMT2A

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-0225673-A1 Process for the preparation of acyl ureas SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1987-06-16 — — EP claimed
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