SCHEMBL8070728

SCHEMBL8070728

O=C(CC1(c2ccccc2)CC1)CC1(c2ccccc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.54
MAOB P27338 1/20 0.54
TAAR1 Q96RJ0 1/20 0.54
TSHR P16473 1/20 0.46
LMNA P02545 4/20 0.46
DPP4 P27487 1/20 0.45
AKR1C1 Q04828 1/20 0.45
CNR1 P21554 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HSD11B1 P28845 2/20 0.44
OPRM1 P35372 1/20 0.42
OPRL1 P41146 1/20 0.42
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL4445397 0.90 MAOA (0.48) MAOAMAOBTAAR1TSHRLMNA
SCHEMBL1361875 0.87 TSHR (0.58) MAOAMAOBTAAR1TSHRLMNA
SCHEMBL6583082 0.83 MAOA (0.50) MAOAMAOBTAAR1TSHRLMNA
SCHEMBL27690381 0.81 LMNA (0.54) LMNADPP4AKR1C1SMN1; SMN2L3MBTL1
SCHEMBL625584 0.79 HSD11B1 (0.64) TSHRLMNADPP4AKR1C1SMN1; SMN2
SCHEMBL977926 0.79 HSD11B1 (0.69) TSHRLMNADPP4AKR1C1SMN1; SMN2
SCHEMBL2444780 0.79 MAOA (0.46) MAOAMAOBTAAR1TSHRLMNA
SCHEMBL2439823 0.79 LMNA (0.44) TSHRLMNADPP4AKR1C1SMN1; SMN2
SCHEMBL5365797 0.78 HSD11B1 (0.72) TSHRLMNADPP4AKR1C1SMN1; SMN2
SCHEMBL6554492 0.76 LMNA (0.49) MAOAMAOBTAAR1TSHRLMNA

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-1024135-A1 Aryl and heteroarylcyclopropyl oxime ethers and their use as fungicides and insecticides ROHM AND HAAS COMPANY (US) 2000-08-02 EP disclosed