SCHEMBL8004510

SCHEMBL8004510

O=C(O)C1CCC(C(=O)CCl)O1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GMNN O75496 1/20 0.33
LMNA P02545 1/20 0.33
PMP22 Q01453 1/20 0.33
TFPI2 P48307 1/20 0.33
TP53 P04637 1/20 0.33
NFKB1 P19838 1/20 0.33
THPO P40225 1/20 0.33

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
SCHEMBL68843 0.81 LMNA (0.46) TSHRKDM4EGMNNLMNAPMP22
SCHEMBL38319 0.81 LMNA (0.46) TSHRKDM4EGMNNLMNAPMP22
SCHEMBL25659463 0.78 FFAR3 (0.38) TSHRKDM4EGMNNLMNAPMP22
SCHEMBL18640563 0.74 ALDH1A1 (0.33) TSHRKDM4EGMNNLMNAPMP22
SCHEMBL21987293 0.72 PPM1B (0.37) TSHR
SCHEMBL25659464 0.71 FFAR3 (0.35) TSHRKDM4EGMNNLMNAPMP22
SCHEMBL10669324 0.71 LMNA (0.42) TSHRKDM4EGMNNLMNAPMP22
SCHEMBL70127 0.71 LMNA (0.42) TSHRKDM4EGMNNLMNAPMP22
SCHEMBL14783405 0.70
SCHEMBL16841846 0.70 GMNN (0.37) TSHRKDM4EGMNNLMNAPMP22

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
US-6077952-A Cephaloporins and homologues PFIZER INC. (US) 2000-06-20 US disclosed
US-6020329-A Cephaloporins and homologues, preparations and pharmaceutical compositions PZIFER INC. (US) 2000-02-01 US disclosed
US-6001997-A Cephalosporins and homologues, preparations and pharmaceutical compositions BATESON JOHN HARGREAVES (GB) 1999-12-14 US disclosed
EP-0540609-A1 CEPHALOSPORINS AND HOMOLOGUES, PREPARATIONS AND PHARMACEUTICAL COMPOSITIONS PFIZER INC. (US) 1993-05-12 EP disclosed
WO-1992001696-A1 CEPHALOSPORINS AND HOMOLOGUES, PREPARATIONS AND PHARMACEUTICAL COMPOSITIONS BEECHAM GROUP PLC (GB) 1992-02-06 WO disclosed