SCHEMBL5500433

SCHEMBL5500433

CC1(C)C2CCC1(C)C(OC(=O)CCl)C2

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.63
LMNA P02545 1/20 0.63
CYP19A1 P11511 2/20 0.59

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
SCHEMBL14665425 0.90 ALDH1A1 (0.60) ALDH1A1LMNACYP19A1
SCHEMBL951563 0.90 ALDH1A1 (0.60) ALDH1A1LMNACYP19A1
SCHEMBL2917719 0.87 ALDH1A1 (0.66) ALDH1A1LMNACYP19A1
SCHEMBL29038407 0.87 ALDH1A1 (0.66) ALDH1A1LMNACYP19A1
SCHEMBL4713598 0.87 ALDH1A1 (0.66) ALDH1A1LMNACYP19A1
SCHEMBL19922403 0.86 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1
SCHEMBL309700 0.86 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1
SCHEMBL7429520 0.86 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1
SCHEMBL17627748 0.86 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1
SCHEMBL17035687 0.86 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1638677-A4 CATALYTIC ASYMMETRIC DESYMMETRIZATION OF PROCHIRAL AND MESO CYCLIC ANHYDRIDES UNIV BRANDEIS (US) 2007-10-10 EP disclosed
EP-1638677-A2 CATALYTIC ASYMMETRIC DESYMMETRIZATION OF PROCHIRAL AND MESO CYCLIC ANHYDRIDES Brandeis University (US) 2006-03-29 EP disclosed
WO-2004110609-A2 CATALYTIC ASYMMETRIC DESYMMETRIZATION OF PROCHIRAL AND MESO CYCLIC ANHYDRIDES BRANDEIS UNIVERSITY (US) 2004-12-23 WO disclosed
EP-0093084-B1 1-CARBOXYALKANOYLINDOLINE-2-CARBOXYLIC-ACID ESTERS, THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR THERAPEUTIC USE CIBA-GEIGY AG (CH) 1986-03-12 EP disclosed
EP-0097127-A2 Cephalosporin derivatives, process for their preparation and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1983-12-28 EP disclosed
EP-0093084-A1 1-Carboxyalkanoylindoline-2-carboxylic-acid esters, their preparation, pharmaceutical compositions containing them, and their therapeutic use CIBA-GEIGY AG (CH) 1983-11-02 EP disclosed