SCHEMBL4170197

SCHEMBL4170197

Brc1[c]c(Br)cc(Sc2ccccc2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.39
MAOA P21397 3/20 0.39
MAOB P27338 3/20 0.39
HTR2C P28335 2/20 0.37
HTR6 P50406 1/20 0.37
HPGD P15428 3/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MGLL Q99685 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HTT P42858 2/20 0.34
SIRT1 Q96EB6 1/20 0.34
HTR1A P08908 2/20 0.34
HTR3A P46098 2/20 0.34
MCL1 Q07820 2/20 0.34
BCL2 P10415 1/20 0.34
MAPK1 P28482 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NSD2 O96028 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
SCHEMBL10839690 0.85
SCHEMBL6947110 0.77 MAOA (0.50) RHEBMAOAMAOBHTR2CHTR6
SCHEMBL4449796 0.74 MAOA (0.40) RHEBMAOAMAOBHTR2CHTR6
Diphenylsulfane SCHEMBL28332331 0.74 HPGD (0.60) MAOAMAOBHTR2CHTR6HPGD
Diphenylsulfane SCHEMBL27714827 0.74 HPGD (0.60) MAOAMAOBHTR2CHTR6HPGD
Diphenylsulfane SCHEMBL452 0.74 HPGD (0.60) MAOAMAOBHTR2CHTR6HPGD
Diphenylsulfane SCHEMBL7109540 0.74 HPGD (0.60) MAOAMAOBHTR2CHTR6HPGD
Diphenylsulfane SCHEMBL27611905 0.74 HPGD (0.60) MAOAMAOBHTR2CHTR6HPGD
Diphenylsulfane SCHEMBL29204135 0.72 HPGD (0.52) MAOAMAOBHTR2CHTR6HPGD
SCHEMBL23277364 0.71 MAOA (0.62) MAOAMAOBHTR2CHTR6HPGD

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-20090233962-A1 Amide derivative and insecticide containing the same MITSUI CHEMICALS, INC. (JP) 2009-09-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090233962-A1 Amide derivative and insecticide containing the same CYP1A1, CYP4B1, CYP2E1 RHEB 4138/4885MAOA 370/4885MAOB 711/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.