SCHEMBL7033231

SCHEMBL7033231

CC(C)CP(CC(C)C)c1ccccc1Br

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.37
MAOA P21397 2/20 0.35
MAOB P27338 1/20 0.35
ALDH1A1 P00352 1/20 0.34
GRM2 Q14416 1/20 0.34
F2R P25116 1/20 0.32
ATM Q13315 2/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HTT P42858 1/20 0.31
TAAR1 Q96RJ0 2/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL7088869 0.84 TAAR1 (0.31) MAOAALDH1A1SMN1; SMN2TAAR1L3MBTL1
SCHEMBL14809988 0.78 CYBB (0.33) ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL17529811 0.77 ACHE (0.38) ANPEPMAOAMAOBALDH1A1F2R
SCHEMBL2490256 0.76 ALDH1A1 (0.39) ALDH1A1GRM2TAAR1
SCHEMBL4608738 0.73 LMNA (0.33) ANPEPALDH1A1GAAKMT2AL3MBTL1
SCHEMBL17529702 0.72 CA1 (0.44) ANPEPALDH1A1KMT2AHTTTAAR1
SCHEMBL4717661 0.72 DPP4 (0.35) ALDH1A1KMT2ASMN1; SMN2
SCHEMBL8093265 0.72 ALDH1A1 (0.39) ANPEPALDH1A1GAAKMT2A
SCHEMBL14603853 0.70 ALDH1A1 (0.37) ANPEPMAOAMAOBALDH1A1TAAR1
SCHEMBL17529755 0.69 TRPA1 (0.35) MAOAMAOBATMHTT

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-20030216599-A1 Synthesis of diphosphinoarenes HILLHOUSE JOHN HENRY (CA) 2003-11-20 US disclosed
EP-1284980-A1 SYNTHESIS OF DIPHOSPHINOARENES CYTEC TECHNOLOGY CORP. (US) 2003-02-26 EP disclosed
WO-2001092275-A1 SYNTHESIS OF DIPHOSPHINOARENES CYTEC TECHNOLOGY CORP. (US) 2001-12-06 WO 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-20030216599-A1 Synthesis of diphosphinoarenes PFAS, DDT, CDK8 ANPEP 2716/4885MAOA 694/4885MAOB 2270/4885

“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.