SCHEMBL3364260

SCHEMBL3364260

CCC(NC(=O)NCc1ccccc1)c1cc(C(F)(F)F)ccc1-c1cc(C(F)(F)F)cc(CC(=O)O)n1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 4/20 0.40
MCHR1 Q99705 1/20 0.38
TACR1 P25103 3/20 0.37
CTSA P10619 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
ANPEP P15144 2/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
PDE2A O00408 1/20 0.35
CNR2 P34972 1/20 0.35

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
SCHEMBL3366526 0.92 CTSA (0.41) PTGDR2MCHR1CTSAALDH1A1CNR2
SCHEMBL3367898 0.91 PPID (0.42) PTGDR2MCHR1TACR1CTSAMAPT
SCHEMBL3368281 0.85 PTGDR2 (0.43) PTGDR2TACR1RXRARXRBRXRG
SCHEMBL153051 0.84 PTGDR2 (0.43) PTGDR2TACR1ALDH1A1MAPTRXRA
SCHEMBL3365393 0.83 PPID (0.42) PTGDR2MCHR1CTSA
SCHEMBL1922881 0.82 PTGDR2 (0.41) PTGDR2CTSARXRARXRBRXRG
SCHEMBL140541 0.81 PTGDR2 (0.48) PTGDR2ALDH1A1MAPTANPEPRXRA
SCHEMBL156551 0.81 PTGDR2 (0.42) PTGDR2ALDH1A1MAPTANPEPRXRA
SCHEMBL153692 0.80 PTGDR2 (0.41) PTGDR2RXRARXRBRXRG
SCHEMBL138451 0.79 PTGDR2 (0.62) PTGDR2

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-20110312974-A1 HETEROARYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-12-22 US claimed
WO-2010037059-A2 HETEROARYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-04-01 WO claimed
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 PTGDR2 2/4885MCHR1 1533/4885TACR1 450/4885

“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.