SCHEMBL3626049

SCHEMBL3626049

CC(C)(Cc1cccc(CC(=O)NCc2ccc(C#N)cc2)c1)NC[C@@H](O)c1ccc(O)c(NC=O)c1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 19/20 0.67
CHRM3 P20309 2/20 0.48
ERCC1 P07992 1/20 0.45
ERCC4 Q92889 1/20 0.45

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
SCHEMBL3626044 1.00 ADRB2 (0.67) ADRB2CHRM3ERCC1ERCC4
SCHEMBL3619543 0.92 ADRB2 (0.79) ADRB2CHRM3
SCHEMBL3619539 0.92 ADRB2 (0.79) ADRB2CHRM3
SCHEMBL3623819 0.90 ADRB2 (0.80) ADRB2CHRM3
SCHEMBL5137151 0.90 ADRB2 (0.55) ADRB2
SCHEMBL3623815 0.90 ADRB2 (0.80) ADRB2CHRM3
SCHEMBL5137153 0.90 ADRB2 (0.55) ADRB2
SCHEMBL3623597 0.89 ADRB2 (0.67) ADRB2CHRM3
SCHEMBL3618195 0.89 ADRB2 (0.67) ADRB2CHRM3
SCHEMBL3618094 0.89 ADRB2 (0.67) ADRB2CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1730103-B1 FORMAMIDE DERIVATIVES USEFUL AS ADRENOCEPTOR PFIZER LTD (GB) 2010-05-26 EP claimed
JP-2007530524-A 2007-11-01 JP claimed
EP-1730103-A1 FORMAMIDE DERIVATIVES USEFUL AS ADRENOCEPTOR Pfizer Limited (GB) 2006-12-13 EP claimed
WO-2005092840-A1 FORMAMIDE DERIVATIVES USEFUL AS ADRENOCEPTOR PFIZER LIMITED (GB) 2005-10-06 WO claimed
EP-1730103-B1 FORMAMIDE DERIVATIVES USEFUL AS ADRENOCEPTOR PFIZER LTD (GB) 2010-05-26 EP disclosed
US-7547731-B2 Formamide derivatives for the treatment of diseases PFIZER INC (US) 2009-06-16 US disclosed
US-7241810-B2 Formamide derivatives for the treatment of diseases PFIZER INC (US) 2007-07-10 US disclosed
US-20050215590-A1 Formamide derivatives for the treatment of diseases PFIZER LIMITED (GB) 2005-09-29 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-20050215590-A1 Formamide derivatives for the treatment of diseases FH, FAH, HRH4 ADRB2 751/4885CHRM3 927/4885ERCC1 4467/4885

“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.