SCHEMBL4150198

SCHEMBL4150198

CC(C)(C)OC(=O)NNNC(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.47
GAA P10253 4/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
MAPK1 P28482 1/20 0.43
DGAT1 O75907 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MIF P14174 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
CA12 O43570 2/20 0.38
CA14 Q9ULX7 2/20 0.38

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
SCHEMBL284141 0.88 APLNR (0.55) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL8520807 0.83 APLNR (0.47) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL11525177 0.83 MEN1 (0.56) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL24514107 0.81 APLNR (0.50) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL289320 0.81 APLNR (0.46) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL18329993 0.79 APLNR (0.44) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL8134537 0.79 APLNR (0.44) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL5073789 0.79 APLNR (0.44) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL1717954 0.79 APLNR (0.48) APLNRGAAMEN1KMT2AMAPK1
SCHEMBL9080312 0.79 APLNR (0.44) APLNRGAAMEN1KMT2AMAPK1

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
US-7612084-B2 Amine derivatives for the treatment of asthma and COPD PFIZER INC (US) 2009-11-03 US disclosed
US-20090253739-A1 Amine Derivatives PFIZER INC 2009-10-08 US disclosed
EP-2074094-A1 SULFONAMIDE DERIVATIVES AS ADRENERGIC AGONISTS AND MUSCARINIC ANTAGONISTS Pfizer Limited (GB) 2009-07-01 EP disclosed
EP-1999107-A2 AMINE DERIVATIVES Pfizer Limited (GB) 2008-12-10 EP disclosed
US-20080090873-A1 Sulfonamide derivatives PFIZER INC. 2008-04-17 US disclosed
WO-2008041095-A1 SULFONAMIDE DERIVATIVES AS ADRENERGIC AGONISTS AND MUSCARINIC ANTAGONISTS PFIZER LIMITED (GB) 2008-04-10 WO disclosed
US-20070265303-A1 Amine derivatives PFIZER LIMITED 2007-11-15 US disclosed
WO-2007107828-A2 AMINE DERIVATIVES PFIZER LIMITED (GB) 2007-09-27 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 (3 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-20080090873-A1 Sulfonamide derivatives SULT2A1, SULT1A1, STS APLNR 3709/4885GAA 569/4885MEN1 3246/4885
US-20070265303-A1 Amine derivatives HNMT, HRH4, CMA1 APLNR 3329/4885GAA 1170/4885MEN1 825/4885
US-20090253739-A1 Amine Derivatives HNMT, HRH4, CMA1 APLNR 3329/4885GAA 1170/4885MEN1 825/4885

“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.