SCHEMBL3501385

SCHEMBL3501385

CCCCC(CC)CN(CC(CC)CCCC)n1nnc(-c2ccccc2C)c1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ IDO1 P14902 1/20 0.32
▸ TDO2 P48775 1/20 0.32
▸ DCTPP1 Q9H773 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TLR8 Q9NR97 1/20 0.31
▸ PRSS1 P07477 1/20 0.30
▸ PRSS2 P07478 1/20 0.30
▸ PRSS3 P35030 1/20 0.30
▸ JAK2 O60674 1/20 0.30
▸ JAK1 P23458 1/20 0.30
▸ TYK2 P29597 1/20 0.30
▸ JAK3 P52333 1/20 0.30

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
SCHEMBL4593962 0.79 TLR8 (0.36) ALDH1A1IDO1TDO2DCTPP1LMNA
SCHEMBL27505488 0.78 JAK2 (0.39) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL23722806 0.76 TLR8 (0.36) ALDH1A1CA2CYP3A4KDM4EMEN1
SCHEMBL27358659 0.71 DPP4 (0.39) ALDH1A1CA2CYP3A4KDM4EMEN1
SCHEMBL27636177 0.71 DCTPP1 (0.41) ALDH1A1CYP3A4KDM4EMEN1MAPT
SCHEMBL450024 0.70 ALDH1A1 (0.32) ALDH1A1CA2CYP3A4KDM4EMEN1
SCHEMBL27658616 0.65 CYP4Z1 (0.41) ALDH1A1IDO1TDO2DCTPP1TLR8
SCHEMBL22343046 0.64 ALDH1A1 (0.40) ALDH1A1CA2CYP3A4KDM4EMEN1
O-Xylene SCHEMBL17007543 0.63 ALDH1A1 (0.68) ALDH1A1CA2CYP3A4KDM4EMEN1
SCHEMBL29367533 0.63 GRM2 (0.41) ALDH1A1KDM4EMEN1KMT2ATLR8

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-20100009875-A1 Liquid Additives for the Stabilization of Lubricant Compositions CHEMTURA CORPORATION (US) 2010-01-14 — — US disclosed
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