SCHEMBL27771720

SCHEMBL27771720

NC(=O)c1cccc2c1ccn2CCn1cc(C(c2ccccc2)c2ccccc2)ccc1=O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 9/20 0.47
▸ CNR1 P21554 3/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ HTR6 P50406 1/20 0.38
▸ CREBBP Q92793 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ CNR2 P34972 2/20 0.35
▸ P2RX7 Q99572 2/20 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
SCHEMBL3165167 0.79 PTGDR2 (0.44) PTGDR2
SCHEMBL3164798 0.75 PTGDR2 (0.52) PTGDR2
SCHEMBL27792895 0.75 PTGDR2 (0.44) PTGDR2POLBKDM4E
SCHEMBL3159520 0.74 PTGDR2 (0.46) PTGDR2KDM4E
SCHEMBL3168468 0.74 PTGDR2 (0.57) PTGDR2
SCHEMBL3166129 0.74 PTGDR2 (0.44) PTGDR2
SCHEMBL3168073 0.74 PTGDR2 (0.52) PTGDR2
SCHEMBL3176967 0.72 PTGDR2 (0.51) PTGDR2HTR6
SCHEMBL3165962 0.71 PTGDR2 (0.52) PTGDR2HTR6CREBBPKDM4E
SCHEMBL3165853 0.71 PTGDR2 (0.55) PTGDR2KDM4E

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
CN-102442941-A Polycyclic acid compounds useful as crth2 antagonists and antiallergic agents ASTELLAS PHARMA INC 2012-05-09 — — CN disclosed
CN-101636386-A Polycyclic acid compounds useful as CRTH2 antagonists and antiallergic agents ASTELLAS PHARMA INC 2010-01-27 — — CN disclosed
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