SCHEMBL9469790

SCHEMBL9469790

CCC[C@@]1(C(=O)OC)CC[C@@H](N)C1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
ALDH1A1 P00352 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL9469793 1.00 CYP4F2 (0.37) CYP4F2CYP4A11ALDH1A1L3MBTL1KDM4E
SCHEMBL27542500 0.91 CYP4F2 (0.42) CYP4F2CYP4A11
SCHEMBL10691795 0.91 CYP4F2 (0.42) CYP4F2CYP4A11ALDH1A1L3MBTL1MAPT
SCHEMBL10691801 0.91 CYP4F2 (0.42) CYP4F2CYP4A11ALDH1A1L3MBTL1MAPT
Hydrochloric Acid SCHEMBL27539970 0.89 CYP4F2 (0.41) CYP4F2CYP4A11
SCHEMBL9469539 0.82 CYP4F2 (0.38) CYP4F2CYP4A11ALDH1A1KDM4EMEN1
SCHEMBL9469538 0.82 CYP4F2 (0.38) CYP4F2CYP4A11ALDH1A1KDM4EMEN1
SCHEMBL13827636 0.77 CYP4F2 (0.56) CYP4F2CYP4A11ALDH1A1L3MBTL1KDM4E
SCHEMBL9469577 0.74 CYP4F2 (0.34) CYP4F2CYP4A11ALDH1A1KDM4EMEN1
SCHEMBL14394093 0.74 CYP4F2 (0.41) CYP4F2CYP4A11ALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5192800-A Hypotensive agents PFIZER INC. (US) 1993-03-09 US disclosed
EP-0274234-B1 SPIRO-SUBSITUTED GLUTARAMIDE DIURETIC AGENTS Pfizer Limited (GB) 1991-09-11 EP disclosed
US-5030654-A Glutaramide diuretic agents PFIZER INC. (US) 1991-07-09 US disclosed