SCHEMBL4237116

SCHEMBL4237116

COc1cc([N+](=O)[O-])ccc1Oc1ccc(NC(=O)c2ccc(OC34CCCC(CC3)N4CC(C)(C)C(=O)O)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.41
KMT2A Q03164 7/20 0.41
MAPT P10636 6/20 0.41
HTT P42858 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
ALDH1A1 P00352 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 2/20 0.39
MCHR1 Q99705 1/20 0.39
ABCB1 P08183 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
RAF1 P04049 1/20 0.38
SETD7 Q8WTS6 1/20 0.38
MET P08581 1/20 0.38
ALOX5 P09917 1/20 0.38
PDGFRA P16234 1/20 0.37
KDR P35968 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL4226767 0.88 ALDH1A1 (0.36) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL4233730 0.86 KCNH2 (0.36) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL4236267 0.85 KCNH2 (0.36) MEN1KMT2AALDH1A1
SCHEMBL4237111 0.85 MCHR1 (0.41) MEN1KMT2AALDH1A1SMN1; SMN2RAB9A
SCHEMBL4233632 0.81 ABCG2 (0.45) MEN1KMT2AMAPTHTTRXFP1
SCHEMBL4688699 0.80 MMP13 (0.42) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL4236537 0.76 MAPT (0.44) MEN1KMT2AMAPTHTTRXFP1
SCHEMBL4240029 0.75 MCHR1 (0.43) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL4688703 0.75 MEN1 (0.40) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL4236446 0.74 MCHR1 (0.35) MAPTMCHR1PDGFRA

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R MEN1 2447/4885KMT2A 3436/4885MAPT 1398/4885

“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.