SCHEMBL7995537

SCHEMBL7995537

CCC(Br)c1ccc(C(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 1/20 0.47
HPGD P15428 1/20 0.47
GSK3B P49841 2/20 0.43
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
POLB P06746 2/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CYP2D6 P10635 1/20 0.41
ELANE P08246 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
BRD4 O60885 1/20 0.41
FABP2 P12104 1/20 0.41

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
SCHEMBL7112239 0.85 ADRB2 (0.44) MAPK1HTTHPGDCYP2C9CYP2C19
SCHEMBL28095147 0.84 ALDH1A1 (0.53) SRD5A2MAPK1HTTHPGDKMT2A
SCHEMBL823013 0.82 HDAC8 (0.56) SRD5A2MAPK1HTTHPGDCYP2C9
SCHEMBL9906971 0.81 MAPK1 (0.50) SRD5A2MAPK1HTTHPGDCYP2C9
SCHEMBL8008483 0.80 MAPK1 (0.53) SRD5A2MAPK1HPGDGSK3BCYP2C9
SCHEMBL3901508 0.78 ALDH1A1 (0.50) SRD5A2HTTHPGDCYP2C9CYP2C19
SCHEMBL3151943 0.77 CNR1 (0.60) SRD5A2MAPK1HPGDCYP2C9CYP2C19
SCHEMBL8010830 0.77 SRD5A2 (0.46) SRD5A2MAPK1HTTHPGDCYP2C9
SCHEMBL8011236 0.74 MAPK1 (0.43) SRD5A2MAPK1HTTHPGDCYP2C9
SCHEMBL10697158 0.74 SRD5A2 (0.80) SRD5A2MAPK1HTTHPGDGSK3B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6077866-A EXHIBIT POWERFUL INSECTICIDAL ACTION, ESPECIALLY AGAINST LEPIDOPTERA, COLEOPTERA AND SOIL INSECTS NIHON BAYER AGROCHEM K.K. (JP) 2000-06-20 US disclosed
EP-0742202-B1 Benzophenone hydrazone derivatives as insecticides BAYER AGROCHEM KK (JP) 1999-12-01 EP disclosed
EP-0742202-A2 Benzophenone hydrazone derivatives as insecticides NIHON BAYER AGROCHEM K.K. (JP) 1996-11-13 EP disclosed