SCHEMBL7130226

SCHEMBL7130226

O=C(O)[C@@H]1CCC[C@@H](O)C1O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PEPD P12955 1/20 0.43
MEN1 O00255 1/20 0.40
BLM P54132 1/20 0.40
KMT2A Q03164 1/20 0.40
ACE P12821 1/20 0.35
GABRR1 P24046 1/20 0.35

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
SCHEMBL3097658 1.00 PEPD (0.43) PEPDMEN1BLMKMT2AACE
SCHEMBL2034245 0.84
SCHEMBL5897097 0.84
SCHEMBL2692497 0.84
SCHEMBL3228170 0.84
SCHEMBL25347129 0.84 GABRR1 (0.43) MEN1KMT2AGABRR1
SCHEMBL2693338 0.84
SCHEMBL6559471 0.84
SCHEMBL3228177 0.84
SCHEMBL5897084 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6670168-B1 Cell comprises a modified rapamycin polyketide synthase (PKS) gene cluster with an acyltransferase (AT) domain in extender module 10 having malonyl CoA specificity. KOSAN BIOSCIENCE, INC. 2003-12-30 US disclosed