SCHEMBL9003274

SCHEMBL9003274

Cc1ccc(C(C)C)c(OP(O)(=S)OCl)c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
MAPT P10636 1/20 0.42
LMNA P02545 2/20 0.42
TRPA1 O75762 1/20 0.42
CHRM1 P11229 1/20 0.42
SLC6A2 P23975 1/20 0.42
ADRA1A P35348 1/20 0.42
HTR2B P41595 1/20 0.42
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL9003266 0.84 L3MBTL1 (0.47) L3MBTL1MAPTLMNATRPA1CHRM1
SCHEMBL8020107 0.84 L3MBTL1 (0.41) L3MBTL1MAPTLMNATRPA1CHRM1
SCHEMBL8020105 0.81 L3MBTL1 (0.46) L3MBTL1MAPTLMNATRPA1CHRM1
SCHEMBL8148726 0.81 L3MBTL1 (0.46) L3MBTL1MAPTLMNATRPA1CHRM1
SCHEMBL9003240 0.78 L3MBTL1 (0.36) L3MBTL1MAPTLMNATDP1
SCHEMBL8731929 0.78 LMNA (0.47) L3MBTL1MAPTLMNATRPA1CHRM1
SCHEMBL8641431 0.77 ALDH1A1 (0.40) L3MBTL1MAPTLMNAKDM4EALDH1A1
SCHEMBL6934549 0.76 LMNA (0.46) L3MBTL1MAPTLMNATRPA1CHRM1
SCHEMBL8147941 0.74 ADRB2 (0.43) L3MBTL1MAPTKDM4EALDH1A1TDP1
SCHEMBL27796618 0.74 ALDH1A1 (0.44) L3MBTL1MAPTLMNATRPA1CHRM1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0731805-A1 AMIDES OF ACIDS OF PHOSPHORUS FOR THE EXTRACTION OF METALS ZENECA LIMITED (GB) 1996-09-18 EP disclosed
WO-1995015329-A1 AMIDES OF ACIDS OF PHOSPHORUS FOR THE EXTRACTION OF METALS ZENECA LIMITED (GB) 1995-06-08 WO disclosed