SCHEMBL722535

SCHEMBL722535

Cc1cc2c(C)noc2cc1-c1ccc(-c2ccc(C(N)=O)c(F)c2)s1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 3/20 0.39
BTK Q06187 3/20 0.39
PRF1 P14222 2/20 0.36
BRD4 O60885 2/20 0.35
BRD2 P25440 1/20 0.35
BRD3 Q15059 1/20 0.35
ACVR1 Q04771 1/20 0.35
KDM1A O60341 3/20 0.35
RARA P10276 2/20 0.35
RARB P10826 2/20 0.35
RARG P13631 2/20 0.35
MAPK14 Q16539 1/20 0.34
HSD17B1 P14061 1/20 0.34
HSD17B2 P37059 1/20 0.34
DGAT1 O75907 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33

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
SCHEMBL722988 0.71 FPR2 (0.39) GPR52PRF1ACVR1DGAT1
SCHEMBL724582 0.70 STIM1 (0.59)
SCHEMBL10201106 0.69 STIM1 (0.59) MAPK14
SCHEMBL1701251 0.68 MAPK14 (0.40) BRD4MAPK14FEN1
SCHEMBL722235 0.68 DGAT1 (0.54) GPR52PRF1HSD17B1HSD17B2DGAT1
SCHEMBL722534 0.65 BRD4 (0.33) BRD4
SCHEMBL30864265 0.65 BRD4 (0.46) BRD4BRD2BRD3RARARARB
SCHEMBL724411 0.65 STIM1 (0.48) GPR52PRF1DGAT1ALOX5APFEN1
SCHEMBL8418298 0.64 BRD4 (0.44) BRD4
SCHEMBL2803833 0.63 S1PR1 (0.61) RARARARBRARG

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-20120053210-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2012-03-01 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-20120053210-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 GPR52 1197/4885BTK 2183/4885PRF1 2531/4885

“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.