SCHEMBL9977566

SCHEMBL9977566

CC(C)=C1C(=O)N(c2c(Cl)cc(Cl)cc2Cl)C(=O)C1=C(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HPGD P15428 4/20 0.38
RECQL P46063 4/20 0.38
GAA P10253 3/20 0.38
MAPT P10636 3/20 0.38
POLB P06746 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX12 P18054 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
CYP3A4 P08684 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CA9 Q16790 2/20 0.32
CDK4 P11802 2/20 0.31

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
SCHEMBL1902124 0.74 CA1 (0.45) ALDH1A1CA9CA12
SCHEMBL10936072 0.71 CA9 (0.46) HPGDMEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL465067 0.69 MGLL (0.47) MAPK1HPGDRECQLMAPTMEN1
SCHEMBL9975769 0.68 ADRA2A (0.36) MAPK1L3MBTL1HPGDRECQLMEN1
SCHEMBL1906351 0.68 CA1 (0.45) CA9CA12
SCHEMBL9188786 0.67 KMT2A (0.44) L3MBTL1HPGDGAAMAPTMEN1
SCHEMBL14146557 0.59 MEN1 (0.32) GAAMAPTMEN1KMT2AALDH1A1
SCHEMBL2093961 0.58 KMT2A (0.44) MAPK1L3MBTL1HPGDRECQLMAPT
SCHEMBL10556241 0.58 NAPRT (0.50) MAPK1L3MBTL1HPGDMAPTPOLB
SCHEMBL9837591 0.57 MGLL (0.43) MAPK1HPGDMAPTMEN1KMT2A

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-20120156598-A1 PHOTOSENSITIVE RESIN COMPOSITION FOR MICROLENS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-06-21 US disclosed