SCHEMBL7197201

SCHEMBL7197201

CCOC(=O)CC(NC(=O)Cc1c(C)cc(C)cc1C)c1cccc(NS(=O)(=O)c2cccc(N(C(=O)OC(C)(C)C)C(N)=NC(=O)OC(C)(C)C)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.36
MAPT P10636 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TGFBR1 P36897 2/20 0.32
PKM P14618 1/20 0.32
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
THRB P10828 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL7194485 0.88 MAPT (0.36) F2MAPTALDH1A1TGFBR1LMNA
SCHEMBL7196567 0.87 F2 (0.38) F2MAPTALDH1A1TGFBR1LMNA
SCHEMBL7190513 0.86 F2 (0.41) F2MAPTALDH1A1TGFBR1PKM
SCHEMBL7187086 0.86 F2 (0.37) F2MAPTALDH1A1TGFBR1PKM
SCHEMBL3838833 0.85 F2 (0.34) F2MAPTALDH1A1TGFBR1PKM
SCHEMBL7190085 0.80 F2 (0.36) F2MAPTALDH1A1TGFBR1PKM
SCHEMBL7189141 0.80 ALDH1A1 (0.40) MAPTALDH1A1PKMLMNATP53
SCHEMBL7197225 0.79 MAPT (0.38) F2MAPTALDH1A1PKMLMNA
SCHEMBL7781107 0.76 ALDH1A1 (0.55) MAPTALDH1A1PKMLMNAMAPK1
SCHEMBL3838832 0.73 F2 (0.35) F2MAPTALDH1A1TGFBR1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6589972-B2 Anticancer agents, osteoporosis, arteriosclerosis, restnosis,vision defects BAYER AKTIENGESELLSCHAFT (DE) 2003-07-08 US disclosed
US-20010031788-A1 Beta-phenylalanine derivatives as integrin antagonists SCHOOP ANDREAS (DE) 2001-10-18 US disclosed
US-6291503-B1 β-phenylalanine derivatives as integrin antagonists BAYER AKTIENGESELLSCHAFT (DE) 2001-09-18 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-20010031788-A1 Beta-phenylalanine derivatives as integrin antagonists ITGB4, ITGA4, ITGB2 F2 1860/4885MAPT 3865/4885ALDH1A1 2010/4885

“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.