SCHEMBL18025451

SCHEMBL18025451

CCOC(=O)CC(=O)N(Cc1ccc(-c2ccc(C(F)(F)F)cc2)cc1)C1(CC(=O)OC)CCOCC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR2 P41597 1/20 0.36
▸ TRPM2 O94759 1/20 0.36
▸ PPID Q08752 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CRHBP P24387 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34
▸ CD274 Q9NZQ7 1/20 0.34
▸ MMP1 P03956 1/20 0.34
▸ MMP2 P08253 1/20 0.34
▸ MMP3 P08254 1/20 0.34
▸ MMP9 P14780 1/20 0.34
▸ MMP8 P22894 1/20 0.34
▸ MMP13 P45452 1/20 0.34
▸ MMP14 P50281 1/20 0.34
▸ PPARG P37231 2/20 0.34
▸ POLB P06746 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
SCHEMBL16762036 0.96 CCR2 (0.37) CCR2TRPM2PPIDKDM4EMEN1
SCHEMBL16839110 0.94 CCR2 (0.36) CCR2TRPM2PPIDKDM4EMEN1
SCHEMBL16839930 0.91 LIPE (0.33) PPIDPOLBNPSR1CETPLTB4R2
SCHEMBL16761886 0.73 TSHR (0.41) MMP13
SCHEMBL18025455 0.73 CD274 (0.39) CCR2MAPTCD274MMP1MMP2
SCHEMBL16268713 0.71 GAA (0.39) MAPTKMT2APOLBNPSR1
SCHEMBL16839659 0.71 KCNQ2 (0.41) PPIDKDM4EMEN1HSP90AA1MAPT
SCHEMBL16839822 0.69 MMP2 (0.41) MAPTMMP1MMP2MMP3MMP9
SCHEMBL20197027 0.69 KDM4E (0.37) CCR2KDM4EMEN1HSP90AA1MAPT
SCHEMBL16839843 0.68 PPID (0.45) TRPM2PPIDKDM4EMEN1HSP90AA1

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-9422240-B2 Partially saturated nitrogen-containing heterocyclic compound TAISHO PHARMACEUTICAL CO., LTD (JP) 2016-08-23 — — US disclosed
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