SCHEMBL1676663

SCHEMBL1676663

COC(=O)C(C)(Br)Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 1/20 0.50
SRC P12931 1/20 0.46
ELANE P08246 2/20 0.45
MAPT P10636 3/20 0.41
TSHR P16473 1/20 0.41
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HSD17B10 Q99714 1/20 0.39
PPARG P37231 2/20 0.39
RAB9A P51151 2/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 1/20 0.38
CA4 P22748 1/20 0.38
PPARA Q07869 2/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 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
SCHEMBL11276841 0.90 NPC1 (0.48) KCNN4SRCELANEMAPTTSHR
SCHEMBL7288524 0.82 KCNN4 (0.52) KCNN4SRCELANEMAPTTSHR
SCHEMBL11276779 0.81 GAA (0.41) ELANEMAPTHPGDSMN1; SMN2KDM4E
SCHEMBL11274148 0.81 PPARA (0.56) ELANEMAPTTSHRHPGDSMN1; SMN2
SCHEMBL28644949 0.81 KCNN4 (0.50) KCNN4SRCELANEMAPTTSHR
SCHEMBL8468475 0.81 KCNN4 (0.50) KCNN4SRCELANEMAPTTSHR
SCHEMBL10654216 0.79 KCNN4 (0.48) KCNN4SRCELANEMAPTTSHR
SCHEMBL27438173 0.78 KCNN4 (0.47) KCNN4SRCELANEMAPTTSHR
SCHEMBL11275394 0.77 MAPT (0.49) MAPTSMN1; SMN2NPSR1KDM4EPPARG
SCHEMBL8816512 0.77 KCNN4 (0.50) KCNN4SRCELANEMAPTTSHR

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-20110092553-A1 Substituted Azole Derivatives, Compositions, and Methods of Use TRANSTECH PHARMA, INC. (US) 2011-04-21 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-20110092553-A1 Substituted Azole Derivatives, Compositions, and Methods of Use PTPRO, PTPN5, PTPRE KCNN4 3454/4885SRC 252/4885ELANE 858/4885

“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.