SCHEMBL6523989

SCHEMBL6523989

CC(C)[C@H](C(=O)N1CCC(Oc2ccc(F)cc2)CC1)C(NC(=O)O)C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
SRD5A1 P18405 1/20 0.43
CCR1 P32246 1/20 0.41
EPHX2 P34913 4/20 0.41
HRH3 Q9Y5N1 2/20 0.40
POLB P06746 1/20 0.40
LIPG Q9Y5X9 3/20 0.40
LIPC P11150 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ACACB O00763 1/20 0.39
ADRB2 P07550 1/20 0.39

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
SCHEMBL2773036 0.85 SRD5A1 (0.46) NAMPTLMNAMAPTKMT2ASRD5A1
SCHEMBL2780495 0.84 CCR1 (0.55) NAMPTLMNAKMT2ASRD5A1CCR1
SCHEMBL2775803 0.84 CCR1 (0.55) NAMPTLMNAKMT2ASRD5A1CCR1
SCHEMBL2776968 0.83 NAMPT (0.48) NAMPTSRD5A1CCR1EPHX2HRH3
SCHEMBL2776669 0.82 SRD5A1 (0.45) NAMPTLMNAMAPTKMT2ASRD5A1
SCHEMBL2774857 0.79 SRD5A1 (0.48) NAMPTLMNAMAPTKMT2ASRD5A1
Hydrochloric Acid SCHEMBL2774192 0.79 DPP4 (0.49) NAMPTMAPTSRD5A1EPHX2HRH3
SCHEMBL2774390 0.79 POLB (0.55) NAMPTLMNASRD5A1CCR1EPHX2
SCHEMBL2779917 0.78 NAMPT (0.47) NAMPTSRD5A1CCR1EPHX2POLB
SCHEMBL2776649 0.77 EPHX2 (0.47) NAMPTSRD5A1CCR1EPHX2HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110053933-A1 HYDROXYQUINOXALINECARBOXAMIDE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-03-03 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-20110053933-A1 HYDROXYQUINOXALINECARBOXAMIDE DERIVATIVE F12, F2, C3AR1 NAMPT 1696/4885LMNA 1316/4885MAPT 4885/4885

“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.