SCHEMBL9645346

SCHEMBL9645346

Cc1cc(OCCCCCCCC=CC=CC(N)=O)nc2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 14/20 0.45
HTT P42858 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL9566153 0.92 LTB4R (0.47) LTB4RHTTCTDSP1LMNAL3MBTL1
SCHEMBL9566148 0.92 LTB4R (0.47) LTB4RHTTCTDSP1LMNAL3MBTL1
SCHEMBL9192020 0.84 LTB4R (0.42) LTB4RHTTCTDSP1ALDH1A1LMNA
SCHEMBL9188574 0.84 CNR2 (0.49) LTB4RHTTCTDSP1
SCHEMBL9186459 0.84 LTB4R (0.42) LTB4RHTTCTDSP1ALDH1A1LMNA
SCHEMBL9191021 0.84 CNR2 (0.49) LTB4RHTTCTDSP1
SCHEMBL9455517 0.82 LMNA (0.41) LTB4RHTTCTDSP1MAPTLMNA
SCHEMBL9455512 0.82 LMNA (0.41) LTB4RHTTCTDSP1MAPTLMNA
SCHEMBL9186572 0.75 LTB4R (0.40) LTB4RHTTCTDSP1ALDH1A1LMNA
SCHEMBL9189661 0.75 LTB4R (0.41) LTB4RHTTCTDSP1ALDH1A1MAPT

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-5114940-A Insecticides or anthelmintics from fused ring heterocycles containing amides or thioamides ROUSSEL-UCLAF (FR) 1992-05-19 US disclosed