SCHEMBL15084355

SCHEMBL15084355

Cc1cccc(F)c1CN1CC(C)CC(C)C1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EED O75530 19/20 0.56
HRH4 Q9H3N8 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47

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
SCHEMBL15084365 0.92 HRH3 (0.51) EEDHRH4HRH3
SCHEMBL15084322 0.90 HRH3 (0.53) EEDHRH4HRH3
SCHEMBL15081980 0.89 EED (0.48) EEDHRH4HRH3
SCHEMBL15084358 0.86 EED (0.55) EED
SCHEMBL18360692 0.84 CYP2A13 (0.56) EEDHRH4HRH3
SCHEMBL15084328 0.84 EED (0.50) EED
SCHEMBL15084323 0.82 EED (0.43) EEDHRH4HRH3
SCHEMBL15084321 0.82 MAPK1 (0.51) EEDHRH4HRH3
SCHEMBL15084390 0.79 EED (0.43) EEDHRH4HRH3
SCHEMBL807178 0.79 EED (0.43) EEDHRH4HRH3

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-9242981-B2 Fused pyrazole derivatives as novel ERK inhibitors MERCK SHARP & DOHME CORP. (US) 2016-01-26 US disclosed
US-20130172341-A1 FUSED PYRAZOLE DERIVATIVES AS NOVEL ERK INHIBITORS MERCK SHARP & DOHME LLC 2013-07-04 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-20130172341-A1 FUSED PYRAZOLE DERIVATIVES AS NOVEL ERK INHIBITORS MAPK1, MAPK3, MAP3K1 EED 1580/4885HRH4 2309/4885HRH3 2180/4885

“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.