SCHEMBL81462

SCHEMBL81462

SCCCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.61
IGF1R P08069 1/20 0.58
ALOX15 P16050 1/20 0.58
PNMT P11086 1/20 0.57
TAAR1 Q96RJ0 1/20 0.57
SIGMAR1 Q99720 13/20 0.52
CYP1A2 P05177 2/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
CYP2C19 P33261 1/20 0.50
KMT2A Q03164 1/20 0.50
PYGL P06737 1/20 0.45
CYP2D6 P10635 1/20 0.44
TMEM97 Q5BJF2 1/20 0.44

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
SCHEMBL6011638 0.86 IDO1 (0.67) IDO1IGF1RALOX15PNMTTAAR1
SCHEMBL10607218 0.83 IGF1R (0.58) IDO1IGF1RALOX15PNMTTAAR1
SCHEMBL11443994 0.80 IGF1R (0.60) IDO1IGF1RALOX15PNMTTAAR1
SCHEMBL9177314 0.78 IGF1R (0.58) IDO1IGF1RALOX15PNMTTAAR1
SCHEMBL4037320 0.78 PNMT (0.76) IDO1IGF1RALOX15PNMTTAAR1
SCHEMBL3759207 0.78 IGF1R (0.58) IDO1IGF1RALOX15PNMTTAAR1
SCHEMBL81497 0.78 IGF1R (0.63) IDO1IGF1RALOX15PNMTTAAR1
SCHEMBL79213 0.78 IGF1R (0.58) IDO1IGF1RALOX15PNMTTAAR1
SCHEMBL9576639 0.78 IGF1R (0.58) IDO1IGF1RALOX15PNMTTAAR1
SCHEMBL9177318 0.78 SIGMAR1 (0.62) IDO1IGF1RALOX15PNMTTAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2168944-B1 AMINE COMPOUND AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2016-05-11 EP disclosed
US-8129361-B2 Amine compound and pharmaceutical use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-03-06 US disclosed
US-20100179216-A1 AMINE COMPOUND AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-07-15 US disclosed
EP-2168944-A1 AMINE COMPOUND AND PHARMACEUTICAL USE THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2010-03-31 EP 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-20100179216-A1 AMINE COMPOUND AND PHARMACEUTICAL USE THEREOF HLA-B, HLA-A, HLA-C IDO1 5/4885IGF1R 4690/4885ALOX15 1268/4885

“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.