SCHEMBL659599

SCHEMBL659599

COC(C)Cn1cc(Br)cn1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.46
OPRK1 P41145 1/20 0.40
ALDH1A1 P00352 4/20 0.39
KMT2A Q03164 3/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPT P10636 1/20 0.34
PKM P14618 1/20 0.34
ACHE P22303 2/20 0.34
LMNA P02545 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MGAM O43451 3/20 0.32
GAA P10253 3/20 0.32
SI P14410 3/20 0.32
MGAM2 Q2M2H8 3/20 0.32
MEN1 O00255 1/20 0.31
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL16912027 0.81 ACHE (0.49) HPGDOPRK1ALDH1A1KMT2ATSHR
SCHEMBL15945437 0.80 ACHE (0.35) ACHE
SCHEMBL12017404 0.80 HTR5A (0.36) OPRK1KMT2AACHELMNAGAA
SCHEMBL15947704 0.80 HTR5A (0.36) OPRK1KMT2AACHELMNAGAA
SCHEMBL15651587 0.79 MEN1 (0.43) ALDH1A1KMT2AMAPTPKMACHE
SCHEMBL17076744 0.79 MEN1 (0.43) ALDH1A1KMT2AMAPTPKMACHE
SCHEMBL18712970 0.77 ACHE (0.33) ACHEGAA
SCHEMBL18712973 0.76 ALDH1A1 (0.33) ALDH1A1KMT2AMAPTPKMACHE
SCHEMBL28518544 0.76 OPRK1 (0.44) HPGDOPRK1ALDH1A1KMT2AMAPT
SCHEMBL13738733 0.75 HPGD (0.46) HPGDOPRK1ALDH1A1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8378104-B2 7-aminofuropyridine derivatives OSI Pharmaceuticals, LLC (US) 2013-02-19 US disclosed
US-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI PHARMACEUTICALS, INC. 2012-02-23 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-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES MAP3K5, STK17A, MAPKAPK5 HPGD 2213/4885OPRK1 2958/4885ALDH1A1 490/4885

“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.