SCHEMBL3365393

SCHEMBL3365393

CCOC(=O)Cc1cccc(-c2ccc(C(F)(F)F)cc2C(CC)NC(=O)NCc2ccccc2)n1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPID Q08752 1/20 0.42
CTSA P10619 1/20 0.40
KDM4E B2RXH2 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TRPV3 Q8NET8 1/20 0.38
LMNA P02545 2/20 0.37
POLB P06746 1/20 0.37
DHFR P00374 1/20 0.37
MCHR1 Q99705 1/20 0.36
FPR2 P25090 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
EPHX2 P34913 1/20 0.36
PPARG P37231 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
SCHEMBL3367898 0.93 PPID (0.42) PPIDCTSAKDM4ENPSR1LMNA
SCHEMBL3366526 0.91 CTSA (0.41) CTSATRPV3LMNAMCHR1PTGDR2
SCHEMBL3366611 0.86 PPID (0.42) PPIDKDM4ENPSR1LMNAFPR2
SCHEMBL3364260 0.83 PTGDR2 (0.40) CTSAMCHR1PTGDR2
SCHEMBL135843 0.82 PPID (0.43) PPIDKDM4ENPSR1LMNADHFR
SCHEMBL136731 0.81 PTGDR2 (0.53) PPIDPTGDR2PPARG
SCHEMBL1922624 0.81 PPID (0.40) PPIDCTSAKDM4ENPSR1LMNA
SCHEMBL137545 0.80 PTGDR2 (0.46) PPIDPTGDR2PPARG
SCHEMBL3365386 0.78 PTGDR2 (0.58) PPIDLMNADHFRPTGDR2
SCHEMBL3368281 0.78 PTGDR2 (0.43) LMNAFPR2PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110312974-A1 HETEROARYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-12-22 US disclosed
WO-2010037059-A2 HETEROARYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-04-01 WO 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-20110312974-A1 HETEROARYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 PPID 540/4885CTSA 1886/4885KDM4E 4767/4885

“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.