SCHEMBL11538529

SCHEMBL11538529

CCOC(=O)N1CCC(=O)C(Cc2ccccc2)C1

nearest known ligand 0.81

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TSHR P16473 3/20 0.47
GAA P10253 2/20 0.47
CYP2C19 P33261 1/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 3/20 0.44
CYP1A2 P05177 1/20 0.44
POLB P06746 1/20 0.44
CYP2C9 P11712 1/20 0.44
MAPT P10636 1/20 0.44
CHRM5 P08912 1/20 0.43
CHRM1 P11229 1/20 0.43

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
SCHEMBL4480437 0.85 JAK2 (0.49) GAASMN1; SMN2
SCHEMBL13538763 0.84 SMN1; SMN2 (0.46) L3MBTL1MEN1KMT2ATSHRGAA
SCHEMBL9052963 0.84 TACR3 (0.43) L3MBTL1MEN1KMT2AGAAALDH1A1
SCHEMBL15352654 0.84 TACR3 (0.43) L3MBTL1MEN1KMT2AGAAALDH1A1
SCHEMBL21193740 0.84 SMN1; SMN2 (0.52) L3MBTL1MEN1KMT2ACYP2C19NPC1
SCHEMBL11680904 0.82 L3MBTL1 (0.45) L3MBTL1MEN1KMT2ATSHRGAA
SCHEMBL11680901 0.82 L3MBTL1 (0.45) L3MBTL1MEN1KMT2ATSHRGAA
SCHEMBL21405164 0.82 TMEM97 (0.49) L3MBTL1MEN1KMT2ACYP2C19NPC1
SCHEMBL4364361 0.81 GAA (0.41) L3MBTL1MEN1KMT2ATSHRGAA
SCHEMBL9721933 0.80 TSHR (0.48) L3MBTL1MEN1KMT2ATSHRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4150136-A ANTIDEPRESSANTS, ANALGESICS SANDOZ LTD. (CH) 1979-04-17 US disclosed
US-4081543-A ANTIAGRESSIVE, CENTRAL NERVOUS SYSTEM DEPRESSANTS SANDOZ LTD. (CH) 1978-03-28 US disclosed
US-4034095-A ANTIDEPRESSANT, ANTICHOLINERGIC SANDOZ LTD. (CH) 1977-07-05 US disclosed
US-4024265-A ANTIDEPRESSANTS SANDOZ LTD. (CH) 1977-05-17 US disclosed