SCHEMBL20176706

SCHEMBL20176706

O=C1C2C3C=CC(CC3)C2C(=O)N1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
KMT2A Q03164 2/20 0.36
APEX1 P27695 1/20 0.36
RECQL P46063 1/20 0.36
ALDH1A1 P00352 5/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ATM Q13315 1/20 0.35
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL14564324 0.90 ALDH1A1 (0.46) L3MBTL1TDP1KMT2ARECQLALDH1A1
SCHEMBL107102 0.90 ALDH1A1 (0.46) L3MBTL1TDP1KMT2ARECQLALDH1A1
SCHEMBL14448181 0.90 ALDH1A1 (0.46) L3MBTL1TDP1KMT2ARECQLALDH1A1
SCHEMBL14491491 0.90 ALDH1A1 (0.46) L3MBTL1TDP1KMT2ARECQLALDH1A1
SCHEMBL13327360 0.86 POLB (0.33) POLBKMT2A
SCHEMBL4831836 0.84
SCHEMBL4834444 0.83 ALDH1A1 (0.36) POLBTDP1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11941653 0.80 ALDH1A1 (0.38) POLBL3MBTL1KMT2AALDH1A1SMN1; SMN2
SCHEMBL13135726 0.79 PPM1B (0.36) L3MBTL1TDP1SMN1; SMN2
SCHEMBL14448183 0.79 ATM (0.42) POLBALDH1A1ATMNPC1HPGD

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
US-20180143546-A1 METHOD FOR PRODUCING CURABLE LIQUID DEVELOPER CANON KABUSHIKI KAISHA (JP) 2018-05-24 US disclosed