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SCHEMBL6287166

SCHEMBL6287166

CCc1cc(C(=O)N2c3ccccc3[C@H](N(C(C)=O)c3ccccc3)C[C@@H]2C)no1.COc1cc(C(=O)N2c3ccccc3[C@H](N(C(C)=O)c3ccccc3)C[C@@H]2C)cc(OC)n1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 15/20 0.61
▸ MEN1 O00255 2/20 0.60
▸ KMT2A Q03164 2/20 0.60
▸ LMNA P02545 2/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ HTT P42858 1/20 0.54
▸ TSHR P16473 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53

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
SCHEMBL6287156 1.00 PTGDR2 (0.61) PTGDR2MEN1KMT2ALMNASMN1; SMN2
SCHEMBL6287154 1.00 PTGDR2 (0.61) PTGDR2MEN1KMT2ALMNASMN1; SMN2
SCHEMBL6287163 0.93 PTGDR2 (0.59) PTGDR2MEN1KMT2A
SCHEMBL5402868 0.91 PTGDR2 (0.66) PTGDR2MEN1KMT2ALMNASMN1; SMN2
SCHEMBL5402860 0.91 PTGDR2 (0.66) PTGDR2MEN1KMT2ALMNASMN1; SMN2
SCHEMBL5402858 0.91 PTGDR2 (0.66) PTGDR2MEN1KMT2ALMNASMN1; SMN2
SCHEMBL6244578 0.90 PTGDR2 (0.53) PTGDR2MEN1KMT2A
SCHEMBL5397352 0.89 PTGDR2 (0.76) PTGDR2MEN1KMT2ALMNASMN1; SMN2
SCHEMBL5397346 0.89 PTGDR2 (0.76) PTGDR2MEN1KMT2ALMNASMN1; SMN2
SCHEMBL5397371 0.89 PTGDR2 (0.76) PTGDR2MEN1KMT2ALMNASMN1; SMN2

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
EP-1556356-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CRTH2 ANTAGONISTS Warner-Lambert Company LLC (US) 2005-07-27 — — EP claimed
WO-2004035543-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CRTH2 ANTAGONISTS WARNER-LAMBERT COMPANY LLC (US) 2004-04-29 — — WO claimed
EP-1556356-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CRTH2 ANTAGONISTS Warner-Lambert Company LLC (US) 2005-07-27 — — EP disclosed
WO-2004035543-A1 TETRAHYDROQUINOLINE DERIVATIVES AS CRTH2 ANTAGONISTS WARNER-LAMBERT COMPANY LLC (US) 2004-04-29 — — WO disclosed