SCHEMBL29665696

SCHEMBL29665696

Cc1ccccc1C[C@](C)(N)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 2/20 0.50
ALDH1A1 P00352 5/20 0.46
HPGD P15428 4/20 0.46
GAA P10253 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 1/20 0.46
USP2 O75604 1/20 0.46
EGFR P00533 1/20 0.46
CYP1A2 P05177 1/20 0.46
FYN P06241 1/20 0.46
POLB P06746 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
APEX1 P27695 1/20 0.46
ADRA1A P35348 1/20 0.46
PTGS2 P35354 1/20 0.46
MTOR P42345 1/20 0.46
RECQL P46063 1/20 0.46

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
SCHEMBL23009700 0.84 BLM (0.51) BLMALDH1A1HPGDGAAKMT2A
SCHEMBL28395639 0.83 ALDH1A1 (0.41) BLMALDH1A1HPGDGAAKMT2A
SCHEMBL2034707 0.82 CTBP2 (0.47) ALDH1A1HPGDGAAKMT2AKDM4E
SCHEMBL2032866 0.82 CTBP2 (0.47) ALDH1A1HPGDGAAKMT2AKDM4E
SCHEMBL11877078 0.82 BLM (0.54) BLMALDH1A1HPGDGAAKMT2A
SCHEMBL4458475 0.81 KDM4E (0.51) ALDH1A1HPGDGAAKMT2AKDM4E
SCHEMBL427854 0.81 BLM (0.49) BLMALDH1A1HPGDGAAKMT2A
SCHEMBL28690512 0.81 BLM (0.49) BLMALDH1A1HPGDGAAKMT2A
SCHEMBL427855 0.81 BLM (0.49) BLMALDH1A1HPGDGAAKMT2A
SCHEMBL29521900 0.81 BLM (0.49) BLMALDH1A1HPGDGAAKMT2A

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
WO-2022178366-A1 GLP-1R, GIP-R AND/OR GCGR AGONISTS, FORMULATIONS, AND METHODS OF USE SPITFIRE PHARMA LLC (US) 2022-08-25 WO disclosed