SCHEMBL11301003

SCHEMBL11301003

Cc1ccccc1C(=O)c1ccc(Sc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
HPGD P15428 3/20 0.58
LMNA P02545 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
AKR1C3 P42330 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
MAPT P10636 1/20 0.50
MAPK13 O15264 2/20 0.49
MAPK12 P53778 2/20 0.49
MAPK11 Q15759 2/20 0.49
MAPK14 Q16539 2/20 0.49
HTT P42858 1/20 0.47
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
FFAR1 O14842 1/20 0.44
CDC25B P30305 1/20 0.43
ATM Q13315 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL29503071 0.85 HPGD (0.56) ALDH1A1HPGDLMNAL3MBTL1MEN1
SCHEMBL22721231 0.85 CES1 (0.46) ALDH1A1HPGDLMNAL3MBTL1AKR1C3
SCHEMBL11755302 0.84 MAPK13 (0.50) ALDH1A1HPGDLMNAAKR1C3MEN1
SCHEMBL29402362 0.83 AKR1C3 (0.61) ALDH1A1HPGDAKR1C3KMT2AMAPT
Benzene SCHEMBL27600962 0.83 AKR1C3 (0.61) ALDH1A1HPGDAKR1C3KMT2AMAPT
SCHEMBL236 0.83 AKR1C3 (0.61) ALDH1A1HPGDAKR1C3KMT2AMAPT
SCHEMBL9451511 0.83 AKR1C3 (0.61) ALDH1A1HPGDAKR1C3KMT2AMAPT
SCHEMBL17069986 0.82 LMNA (0.42) ALDH1A1HPGDLMNAL3MBTL1AKR1C3
SCHEMBL28328091 0.82 MEN1 (0.44) ALDH1A1HPGDLMNAAKR1C3MEN1
SCHEMBL2518515 0.82 AKR1C3 (0.61) ALDH1A1AKR1C3MAPK13MAPK12MAPK11

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-4324628-A PHOTOPOLYMERIZATION OF UNSATURATED COMPOUNDS SANDOZ LTD. (CH) 1982-04-13 US disclosed