SCHEMBL692885

SCHEMBL692885

CS(=O)(=O)n1c(=O)n(-c2ccc(Br)cc2F)c2cc(=O)n3c(c21)CCC3

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.35
MAOB P27338 2/20 0.32
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
MAPT P10636 2/20 0.31
CCR1 P32246 1/20 0.31
CCR2 P41597 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
SLC22A12 Q96S37 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL698378 0.88 CCR1 (0.32) RXFP1ALOX15TSHRCCR1CCR2
SCHEMBL4338582 0.86 HTR6 (0.37) TSHRMAPTALDH1A1LMNAGAA
SCHEMBL697674 0.83 NR1H3 (0.35) TSHRMAPTALDH1A1LMNAGAA
SCHEMBL3796822 0.80 SLC22A12 (0.34) RXFP1MAOBMAPTCCR1CCR2
SCHEMBL696821 0.77 USP30 (0.36) RXFP1MAPTCCR1CCR2SLC22A12
SCHEMBL696579 0.75 RXFP1 (0.34) RXFP1MAOBALOX15TSHRMAPT
SCHEMBL696412 0.74 RXFP1 (0.33) RXFP1MAOBALOX15TSHRCCR1
SCHEMBL699800 0.73 MEN1 (0.39) RXFP1MAPTALDH1A1LMNAGAA
SCHEMBL13148379 0.70 RXFP1 (0.36) RXFP1MAOBMAPTCCR1CCR2
SCHEMBL13147936 0.70 MAP2K1 (0.32) RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2421612-A1 HETEROCYCLIC COMPOUNDS AS MEK INHIBITORS Novartis AG (CH) 2012-02-29 EP claimed
WO-2010121646-A1 HETEROCYCLIC COMPOUNDS AS MEK INHIBITORS NOVARTIS AG (CH) 2010-10-28 WO claimed
US-20090275606-A1 Heterocyclic Compounds as MEK Inhibitors NOVARTIS AG 2009-11-05 US claimed
EP-2421612-A1 HETEROCYCLIC COMPOUNDS AS MEK INHIBITORS Novartis AG (CH) 2012-02-29 EP disclosed
WO-2010121646-A1 HETEROCYCLIC COMPOUNDS AS MEK INHIBITORS NOVARTIS AG (CH) 2010-10-28 WO disclosed
WO-2010121646-A1 HETEROCYCLIC COMPOUNDS AS MEK INHIBITORS NOVARTIS AG (CH) 2010-10-28 WO disclosed
US-20090275606-A1 Heterocyclic Compounds as MEK Inhibitors NOVARTIS AG 2009-11-05 US disclosed
US-20090275606-A1 Heterocyclic Compounds as MEK Inhibitors NOVARTIS AG 2009-11-05 US disclosed
US-20090275606-A1 Heterocyclic Compounds as MEK Inhibitors NOVARTIS AG 2009-11-05 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-20090275606-A1 Heterocyclic Compounds as MEK Inhibitors NRAS, BRAF, MAP3K1 RXFP1 4597/4885MAOB 2224/4885ALOX15 836/4885

“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.