SCHEMBL5149356

SCHEMBL5149356

CCCOc1ccc(I)cc1C(=O)N[C@H](O)C(C)c1c[nH]c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
MAPK1 P28482 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
SSTR2 P30874 4/20 0.37
ALDH1A1 P00352 1/20 0.37
CNR2 P34972 1/20 0.37
CCKBR P32239 1/20 0.36
FFAR1 O14842 1/20 0.36
GPR84 Q9NQS5 1/20 0.36
CFTR P13569 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
SCHEMBL5149347 1.00 KDM4E (0.38) KDM4EMAPK1MAPTMEN1KMT2A
SCHEMBL4035244 0.89 SCN8A (0.39) ALDH1A1
SCHEMBL4032359 0.87 KMT2A (0.47) MAPTMEN1KMT2ACNR2FFAR1
SCHEMBL4032356 0.87 KMT2A (0.47) MAPTMEN1KMT2ACNR2FFAR1
SCHEMBL5149435 0.81 MEN1 (0.39) KDM4EMEN1KMT2AALDH1A1CNR2
SCHEMBL5149423 0.81 MEN1 (0.39) KDM4EMEN1KMT2AALDH1A1CNR2
SCHEMBL5172047 0.80 CCKBR (0.44) KDM4EMAPK1MAPTMEN1KMT2A
SCHEMBL4599804 0.80 CCKBR (0.44) KDM4EMAPK1MAPTMEN1KMT2A
SCHEMBL4632723 0.76 ALOX5 (0.41) KDM4EMAPK1MAPTMEN1KMT2A
SCHEMBL4632727 0.76 ALOX5 (0.41) KDM4EMAPK1MAPTMEN1KMT2A

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-20070060573-A1 Acyltryptophanols BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-03-15 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-20070060573-A1 Acyltryptophanols FSHR, NPY1R, NPY2R KDM4E 2399/4885MAPK1 3998/4885MAPT 4047/4885

“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.