SCHEMBL30985265

SCHEMBL30985265

C=CCC(CC=C)(CC=C)CNC(=O)CCCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
TSHR P16473 2/20 0.47
ABCC4 O15439 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
FAAH O00519 4/20 0.44
EPHX2 P34913 3/20 0.41
LMNA P02545 2/20 0.40
NFKB1 P19838 1/20 0.40
PMP22 Q01453 1/20 0.40
PRMT1 Q99873 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KDM4E B2RXH2 1/20 0.38
CNR1 P21554 2/20 0.37
CNR2 P34972 2/20 0.37
ADRA1A P35348 1/20 0.37

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
SCHEMBL30763454 0.85 FAAH (0.63) TSHRSMN1; SMN2FAAHEPHX2CNR1
SCHEMBL24013311 0.83 TSHR (0.46) MAPTTSHRSMN1; SMN2FAAHALDH1A1
SCHEMBL30985264 0.83 ALDH1A1 (0.54) MAPTTSHRSMN1; SMN2FAAHEPHX2
SCHEMBL30884807 0.81 TSHR (0.42) MAPTTSHRSMN1; SMN2FAAHALDH1A1
SCHEMBL22508718 0.77 TSHR (0.80) MAPTTSHRABCC4SMN1; SMN2FAAH
SCHEMBL7037455 0.77 TSHR (0.80) MAPTTSHRABCC4SMN1; SMN2FAAH
SCHEMBL24013260 0.75 TSHR (0.39) MAPTTSHRSMN1; SMN2FAAH
SCHEMBL6881087 0.74 TSHR (0.83) MAPTTSHRABCC4SMN1; SMN2FAAH
SCHEMBL24614832 0.73 KMT2A (0.40) MAPTTSHRSMN1; SMN2FAAHALDH1A1
SCHEMBL31169261 0.73 SMN1; SMN2 (0.40) MAPTTSHRSMN1; SMN2ALDH1A1

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-2024143404-A1 ALKYLENE CHAIN-CONTAINING SILANE COMPOUND ダイキン工業株式会社 2024-07-04 WO disclosed