SCHEMBL23938434

SCHEMBL23938434

CCCCc1cccc(CNC)c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ PRMT6 Q96LA8 6/20 0.46
▸ LPL P06858 2/20 0.46
▸ LIPG Q9Y5X9 2/20 0.46
▸ NOS1 P29475 3/20 0.45
▸ NOS3 P29474 2/20 0.44
▸ EPHX2 P34913 1/20 0.44
▸ XIAP P98170 1/20 0.43
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42

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
SCHEMBL22113441 0.94 LPL (0.53) KDM4ECYP3A4MAPTPRMT6LPL
SCHEMBL8491487 0.88 KDM4E (0.50) KDM4ECYP3A4MAPTPRMT6NOS1
SCHEMBL347126 0.85 LPL (0.57) LPLLIPGXIAP
SCHEMBL3052902 0.85 TAAR1 (0.59) KDM4EMAPTLPLLIPGNOS1
SCHEMBL5433566 0.84 LPL (0.52) LPLLIPGXIAP
SCHEMBL1697126 0.83 MAPT (0.64) KDM4ECYP3A4MAPTPRMT6NOS1
SCHEMBL28141752 0.81 LPL (0.63) CYP3A4LPLLIPGXIAP
SCHEMBL28409443 0.81 LPL (0.53) LPLLIPGXIAP
Hydrochloric Acid SCHEMBL3273205 0.81 MAPT (0.68) KDM4ECYP3A4MAPTPRMT6NOS1
SCHEMBL8094986 0.80 LPL (0.49) LPLLIPGXIAP

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
EP-3297438-B1 CCR2 MODULATORS CHEMOCENTRYX INC (US) 2021-10-20 — — EP disclosed
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