SCHEMBL29068102

SCHEMBL29068102

Brc1ncnn1CC1CC1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 14/20 0.39
PKM P14618 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL24828311 0.77 CSF1R (0.35) L3MBTL1
SCHEMBL23989427 0.76 L3MBTL1 (0.41) GRM2ALDH1A1LMNAL3MBTL1MAPT
SCHEMBL24828656 0.75 LMNA (0.32) GRM2LMNA
SCHEMBL24769770 0.73 MAPT (0.38) GRM2ALDH1A1LMNAL3MBTL1MAPT
SCHEMBL12680642 0.72 CNR2 (0.38) GRM2ALDH1A1LMNAL3MBTL1MAPT
SCHEMBL23990298 0.71 NOTUM (0.37) ALDH1A1LMNAL3MBTL1MAPT
SCHEMBL3023622 0.69 HDAC1 (0.44) ALDH1A1LMNAL3MBTL1MAPT
SCHEMBL400637 0.69 LMNA (0.35) ALDH1A1LMNAL3MBTL1MAPT
SCHEMBL8436826 0.69 PKM (0.40) GRM2PKMALDH1A1LMNAMAPT
SCHEMBL24828685 0.69 PDE2A (0.33)

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
CN-116669727-A Triazole-pyridinyl substituted azacyclohexylacetic acid compounds as LPA receptor antagonists 唯久生物有限公司 2023-08-29 CN disclosed