SCHEMBL9059652

SCHEMBL9059652

O=[C][C@@H](Cc1ccccc1)N1CCCCC1=O

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.48
CHRM2 P08172 1/20 0.44
CHRM4 P08173 1/20 0.44
CHRM5 P08912 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
POLB P06746 1/20 0.42
ALDH1A1 P00352 1/20 0.40
PKM P14618 1/20 0.40
LMNA P02545 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
SCHEMBL9057459 0.95 CHRM2 (0.45) L3MBTL1CHRM2CHRM4CHRM5CHRM1
SCHEMBL9058004 0.87 ALDH1A1 (0.39) L3MBTL1CHRM2CHRM4CHRM5CHRM1
SCHEMBL9058947 0.85 HRH3 (0.43) L3MBTL1CHRM2CHRM4CHRM5CHRM1
SCHEMBL9057843 0.84 MC4R (0.40) L3MBTL1CHRM2CHRM4CHRM5CHRM1
SCHEMBL9057546 0.82 HRH3 (0.40) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL12814048 0.80 ALDH1A1 (0.54) L3MBTL1CHRM2CHRM4CHRM5CHRM1
SCHEMBL9057438 0.79 HCRTR1 (0.43) ALDH1A1LMNA
SCHEMBL9057980 0.79 HCRTR1 (0.39) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9074197 0.77 ALDH1A1 (0.61) L3MBTL1MEN1KMT2APOLBALDH1A1
SCHEMBL10588007 0.76 ALDH1A1 (0.57) L3MBTL1CHRM2CHRM4CHRM5CHRM1

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
WO-1996017862-A1 LHRH ANTAGONISTS HAVING LACTAM GROUPS AT THE N-TERMINUS ABBOTT LABORATORIES (US) 1996-06-13 WO disclosed
US-5516759-A LHRH antagonists having lactam groups at the N-terminus TAP HOLDINGS INC. (US) 1996-05-14 US disclosed