SCHEMBL13664479

SCHEMBL13664479

Cc1ccc(C(=O)c2nn(-c3ccc(Cl)cc3)c(NCCCNC(=O)c3ccc4nc(C(F)(F)F)n(C)c4c3)c2C#N)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACSS2 Q9NR19 5/20 0.39
CHRM4 P08173 2/20 0.39
TPSAB1 Q15661 3/20 0.39
TPSD1 Q9BZJ3 3/20 0.39
TPSG1 Q9NRR2 3/20 0.39
MAPT P10636 4/20 0.36
GAA P10253 2/20 0.36
POLB P06746 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
BRD4 O60885 2/20 0.35
THRB P10828 2/20 0.35
AR P10275 1/20 0.35
TP53 P04637 1/20 0.35
RHOC P08134 1/20 0.35
RHOA P61586 1/20 0.35
CNR1 P21554 2/20 0.35
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL13664478 0.95 BRD4 (0.36) ACSS2CHRM4MAPTGAAPOLB
SCHEMBL13664435 0.86 RHOC (0.43) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664477 0.85 KDM4E (0.38) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664373 0.85 POLB (0.46) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664143 0.85 POLB (0.46) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664437 0.85 RHOC (0.43) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664413 0.84 NPC1 (0.45) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664389 0.84 DRD3 (0.42) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664403 0.83 L3MBTL1 (0.46) MAPTGAAPOLBTDP1L3MBTL1
SCHEMBL13664484 0.83 MAPT (0.40) MAPTGAAPOLBTDP1L3MBTL1

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-20090253673-A1 Substituted Pyrazoles as Ghrelin Receptor Antagonists MERCK SHARP & DOHME CORP. 2009-10-08 US disclosed
US-20090253673-A1 Substituted Pyrazoles as Ghrelin Receptor Antagonists MERCK SHARP & DOHME CORP. 2009-10-08 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-20090253673-A1 Substituted Pyrazoles as Ghrelin Receptor Antagonists GIPR, GPR119, GLP1R ACSS2 727/4885CHRM4 2371/4885TPSAB1 4154/4885

“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.