SCHEMBL5154424

SCHEMBL5154424

COc1ccc(-c2cccc(C(=O)N[C@@H](CO)Cc3c[nH]c4ccccc34)c2)c(OC)c1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
MEN1 O00255 2/20 0.50
TACR1 P25103 3/20 0.49
HDAC3 O15379 4/20 0.49
HDAC1 Q13547 4/20 0.49
HDAC2 Q92769 4/20 0.49
HDAC6 Q9UBN7 3/20 0.49
HDAC4 P56524 2/20 0.49
HDAC7 Q8WUI4 2/20 0.49
HDAC10 Q969S8 2/20 0.49
HDAC11 Q96DB2 2/20 0.49
HDAC8 Q9BY41 2/20 0.49
HDAC9 Q9UKV0 2/20 0.49
HDAC5 Q9UQL6 2/20 0.49
ROCK2 O75116 2/20 0.47
ROCK1 Q13464 2/20 0.47
CDK4 P11802 1/20 0.46
CCND1 P24385 1/20 0.46
ERAP2 Q6P179 1/20 0.46
CTSL P07711 1/20 0.45

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
SCHEMBL5149250 0.92 HDAC3 (0.51) KMT2AMEN1TACR1HDAC3HDAC1
SCHEMBL5154415 0.89 KMT2A (0.52) KMT2AMEN1TACR1HDAC3HDAC1
SCHEMBL5155523 0.88 TACR1 (0.51) KMT2AMEN1TACR1HDAC3HDAC1
SCHEMBL5152167 0.88 KMT2A (0.51) KMT2AMEN1TACR1HDAC3HDAC1
SCHEMBL4602129 0.88 TACR1 (0.56) KMT2AMEN1TACR1HDAC3HDAC1
SCHEMBL4601301 0.87 KMT2A (0.58) KMT2AMEN1TACR1HDAC3HDAC1
SCHEMBL5152158 0.87 KMT2A (0.58) KMT2AMEN1TACR1HDAC3HDAC1
SCHEMBL5152497 0.85 HDAC3 (0.51) KMT2AMEN1TACR1HDAC3HDAC1
SCHEMBL5149188 0.85 CDK4 (0.54) KMT2AMEN1HDAC3HDAC1HDAC2
SCHEMBL5149237 0.84 CDK4 (0.51) TACR1HDAC3HDAC1HDAC2HDAC6

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070060573-A1 Acyltryptophanols BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-03-15 US claimed
US-20070060573-A1 Acyltryptophanols BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-03-15 US disclosed
US-20070060573-A1 Acyltryptophanols BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-03-15 US disclosed
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 KMT2A 916/4885MEN1 410/4885TACR1 87/4885

“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.