SCHEMBL13664281

SCHEMBL13664281

N#Cc1c(C(=O)c2ccc3c(c2)OCO3)nn(-c2ccc(F)cc2)c1NCCCN

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
TP53 P04637 1/20 0.39
KDM4E B2RXH2 2/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MELK Q14680 1/20 0.38
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
SMYD3 Q9H7B4 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL13664274 0.83 GAA (0.48) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL13664211 0.82 ADORA2A (0.47) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL13664273 0.82 MEN1 (0.42) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL13664395 0.78 RAB9A (0.46) MAPTALDH1A1MEN1KMT2ATSHR
SCHEMBL13664356 0.77 TSHR (0.47) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL13664474 0.77 RAB9A (0.43) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL13664415 0.76 RAB9A (0.42) MAPTALDH1A1MEN1KMT2ATP53
SCHEMBL13664277 0.74 MAPT (0.43) MAPTMEN1KMT2AGAAKDM4E
SCHEMBL13664276 0.74 MAPT (0.41) MAPTMEN1KMT2AGAAKDM4E
SCHEMBL13664185 0.73 LMNA (0.46) MAPTALDH1A1MEN1KMT2AGAA

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 MAPT 4701/4885ALDH1A1 3415/4885MEN1 3462/4885

“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.