SCHEMBL10446002

SCHEMBL10446002

CC1(C(=O)COc2ccc(Cl)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATF4 P18848 5/20 0.56
RAB9A P51151 2/20 0.49
MAPT P10636 2/20 0.49
POLB P06746 1/20 0.49
HPGD P15428 1/20 0.49
PTGS2 P35354 1/20 0.48
L3MBTL1 Q9Y468 3/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C19 P33261 1/20 0.47
NPC1 O15118 1/20 0.47
TSHR P16473 1/20 0.47
BLM P54132 1/20 0.46
PMP22 Q01453 1/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
ADAMTS4 O75173 1/20 0.45

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
SCHEMBL10916844 0.83 ATF4 (0.47) ATF4RAB9AMAPTPOLBHPGD
SCHEMBL9300277 0.81 ATF4 (0.58) ATF4RAB9AMAPTPOLBHPGD
SCHEMBL9578176 0.80 ATF4 (0.52) ATF4RAB9AMAPTPOLBHPGD
SCHEMBL9768233 0.78 ATF4 (0.54) ATF4RAB9AMAPTPOLBHPGD
SCHEMBL9768195 0.76 ABCB11 (0.54) ATF4MAPTPOLBL3MBTL1MEN1
SCHEMBL20610371 0.75 ATF4 (0.78) ATF4RAB9AL3MBTL1MEN1ALDH1A1
SCHEMBL3370944 0.74 PTGS2 (0.56) ATF4RAB9AMAPTPOLBHPGD
SCHEMBL3913180 0.74 PTGS2 (0.60) ATF4RAB9AMAPTPOLBHPGD
SCHEMBL19569414 0.74 ATF4 (0.75) ATF4RAB9AL3MBTL1MEN1ALDH1A1
SCHEMBL11440981 0.74 MAPT (0.60) ATF4RAB9AMAPTPOLBHPGD

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
EP-0384246-A2 Cyclopropyl-hydroxyethyl-azolyl derivatives BAYER AG (DE) 1990-08-29 EP disclosed