SCHEMBL4227306

SCHEMBL4227306

CCOC(=O)CNC(=O)c1cc2cc(-c3ccc(C(C)(C)C)cc3)ccc2n1-c1ccc(OC2CCCC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.49
MAPT P10636 3/20 0.38
LMNA P02545 2/20 0.38
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
S1PR3 Q99500 1/20 0.36
DPP4 P27487 3/20 0.35
DPP8 Q6V1X1 1/20 0.35
GCGR P47871 2/20 0.35
ALDH1A1 P00352 2/20 0.35
FDPS P14324 1/20 0.34
ACACB O00763 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34

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
SCHEMBL4228521 0.91 PTGES (0.54) PTGESMAPTLMNAGCGRALDH1A1
SCHEMBL3001562 0.88 PTGES (0.54) PTGESMAPTLMNACYP2C9CYP2C19
SCHEMBL4228950 0.86 PTGES (0.52) PTGESMAPTLMNAGCGR
SCHEMBL4228392 0.86 PTGES (0.48) PTGESMAPTLMNAGCGRALDH1A1
SCHEMBL3572573 0.85 PTGES (0.56) PTGESMAPTCYP2C9CYP2C19ALDH1A1
SCHEMBL2997608 0.85 PTGES (0.42) PTGESMAPTLMNACYP2C9CYP2C19
SCHEMBL4226260 0.85 PTGES (0.49) PTGESMAPTLMNAGCGRALDH1A1
SCHEMBL3000520 0.84 PTGES (0.45) PTGESMAPTLMNACYP2C9CYP2C19
SCHEMBL3578255 0.84 PTGES (0.69) PTGESMAPTLMNAGCGRALDH1A1
SCHEMBL4218509 0.83 PTGES (0.52) PTGESMAPTLMNAACACB

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-20090042949-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-02-12 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-20090042949-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, AREG PTGES 28/4885MAPT 60/4885LMNA 3630/4885

“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.