SCHEMBL18576765

SCHEMBL18576765

C=C(C)C1CCCN1C(=C)CC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ DPP4 P27487 2/20 0.32
▸ PREP P48147 1/20 0.32
▸ POLB P06746 2/20 0.31
▸ DPP8 Q6V1X1 1/20 0.31
▸ DPP9 Q86TI2 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ REN P00797 3/20 0.31
▸ ACE P12821 4/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ F2 P00734 1/20 0.30
▸ LTA4H P09960 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ PEPD P12955 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ PTGS1 P23219 1/20 0.30
▸ HTR2A P28223 1/20 0.30
▸ PTGS2 P35354 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
SCHEMBL18573595 0.83 LMNA (0.55) HSD17B10LMNACYP2C19RENACE
SCHEMBL12704221 0.80 HSD17B10 (0.38) HSD17B10LMNACYP2C19DPP4PREP
SCHEMBL26167163 0.80 LMNA (0.33) HSD17B10LMNACYP2C19DPP4POLB
SCHEMBL20416167 0.76 KMT2A (0.40) POLBL3MBTL1KDM4EMAPT
SCHEMBL22296753 0.75 POLB (0.33) HSD17B10LMNACYP2C19POLBL3MBTL1
SCHEMBL24287714 0.72 HSD17B10 (0.40) HSD17B10LMNACYP2C19POLB
SCHEMBL26433850 0.72 POLB (0.31) POLBL3MBTL1
SCHEMBL18592162 0.72 POLB (0.35) DPP4POLBDPP8L3MBTL1
SCHEMBL23073833 0.71 DPP4 (0.35) DPP4PREPPOLBDPP8DPP9
SCHEMBL18536645 0.71 ITGB1 (0.51) L3MBTL1

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
WO-2017035401-A1 AMIDE COMPOUNDS FOR TREATMENT OF IMMUNE AND INFLAMMATORY DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2017-03-02 — — WO disclosed
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