SCHEMBL9360852

SCHEMBL9360852

NCC(CC1(C(=O)O)CCCC1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.45
MME P08473 18/20 0.41
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
TSHR P16473 1/20 0.34
BLM P54132 1/20 0.34
CACNA2D1 P54289 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL4001502 0.78 MME (0.37) MMEUSP2ALDH1A1LMNACYP1A2
SCHEMBL27590820 0.78 MME (0.49) CYP2C19MME
SCHEMBL4001628 0.77 MME (0.36) MMEUSP2ALDH1A1LMNACYP1A2
SCHEMBL9341047 0.77 CYP2C19 (0.36) CYP2C19MME
SCHEMBL7368344 0.77 CYP2C19 (0.36) CYP2C19MME
SCHEMBL9337097 0.77 CYP2C19 (0.36) CYP2C19MME
SCHEMBL3998168 0.76 USP2 (0.39) MMEUSP2ALDH1A1LMNACYP1A2
SCHEMBL7296981 0.76 CYP2C19 (0.35) CYP2C19MME
SCHEMBL4001005 0.74 TSHR (0.35) CYP2C19MMETSHR
SCHEMBL3999952 0.74 USP2 (0.42) MMEUSP2ALDH1A1LMNACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0432898-B1 Glutaric acid derivatives and preparation thereof PFIZER LTD (GB) 1994-04-13 EP disclosed
US-5260467-A Glutaric acid derivatives and preparation thereof PFIZER INC. (US) 1993-11-09 US disclosed
US-5157138-A Glutaric acid derivatives and preparation thereof PFIZER, INC. (US) 1992-10-20 US disclosed
US-5087732-A GLUTARIC ACID DERIVATIVES AND PREPARATION THEREOF PFIZER INC. (US) 1992-02-11 US disclosed
EP-0432898-A2 Glutaric acid derivatives and preparation thereof Pfizer Limited (GB) 1991-06-19 EP disclosed