SCHEMBL2012264

SCHEMBL2012264

CC(C)(C)OC(=O)NCCc1ccc(NC(=O)c2ccccc2CNC(=O)OC(C)(C)C)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.58
KCNA5 P22460 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 2/20 0.48
LMNA P02545 1/20 0.48
ALDH1A1 P00352 2/20 0.47
ADRB2 P07550 1/20 0.47
KDR P35968 1/20 0.47
MAPT P10636 4/20 0.44
TDP1 Q9NUW8 4/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
NQO2 P16083 1/20 0.43
SLC6A5 Q9Y345 2/20 0.42
DRD2 P14416 1/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
RAB9A P51151 1/20 0.42
ESRRG P62508 1/20 0.42
HDAC10 Q969S8 1/20 0.42

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
SCHEMBL4985408 0.84 SLC6A5 (0.57) NAMPTKCNA5SLC6A5NPC1RAB9A
SCHEMBL2873843 0.82 NAMPT (0.64) NAMPTNPC1RAB9AESRRG
SCHEMBL12434160 0.81 KCNA5 (0.61) NAMPTKCNA5SMN1; SMN2KDM4EALDH1A1
SCHEMBL4679965 0.79 F10 (0.48) NAMPTKCNA5KDRNPC1TP53
SCHEMBL7079568 0.78 NAMPT (0.57) NAMPTSMN1; SMN2KDM4ELMNAALDH1A1
SCHEMBL24352345 0.78 KCNA5 (0.57) NAMPTKCNA5KDM4EALDH1A1CA1
SCHEMBL29473197 0.78 KCNA5 (0.57) NAMPTKCNA5KDM4EALDH1A1CA1
SCHEMBL25762436 0.78 KCNA5 (0.56) NAMPTKCNA5LMNACA1NQO2
SCHEMBL12434478 0.78 KCNA5 (0.73) KCNA5NPC1RAB9A
SCHEMBL13789545 0.78 KCNA5 (0.64) NAMPTKCNA5SMN1; SMN2LMNAMAPT

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-7964730-B2 Amino-substituted ethylamino β2 adrenergic receptor agonists THERAVANCE, INC. (US) 2011-06-21 US disclosed
US-20090111850-A1 Amino-Substituted Ethylamino Beta2 Adrenergic Receptor Agonists THERAVANCE BIOPHARMA R&D IP, LLC 2009-04-30 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-20090111850-A1 Amino-Substituted Ethylamino Beta2 Adrenergic Receptor Agonists ADRB2, ADRB1, ADRA2A NAMPT 3500/4885KCNA5 604/4885SMN1; SMN2 1912/4885

“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.