SCHEMBL15329802

SCHEMBL15329802

N[C@@H](CO)c1ccc(C=O)cn1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KCNJ1 P48048 1/20 0.35
ALDH5A1 P51649 1/20 0.33
ABAT P80404 1/20 0.33
TYR P14679 1/20 0.31
PTGS2 P35354 1/20 0.31
RAB9A P51151 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL15332266 1.00 ALDH1A1 (0.35) ALDH1A1KDM4EL3MBTL1KCNJ1ALDH5A1
SCHEMBL15332988 0.84 ALDH1A1 (0.36) ALDH1A1KDM4EL3MBTL1KCNJ1ALDH5A1
SCHEMBL15331595 0.84 ALDH1A1 (0.36) ALDH1A1KDM4EL3MBTL1KCNJ1ALDH5A1
SCHEMBL15330602 0.82 KDM4E (0.38) ALDH1A1KDM4EL3MBTL1KCNJ1TYR
SCHEMBL2559868 0.82 KDM4E (0.38) ALDH1A1KDM4EL3MBTL1KCNJ1TYR
SCHEMBL20578703 0.82 KDM4E (0.38) ALDH1A1KDM4EL3MBTL1KCNJ1TYR
SCHEMBL15331558 0.79 KDM4E (0.36) ALDH1A1KDM4EL3MBTL1KCNJ1TYR
SCHEMBL2561652 0.79 KDM4E (0.36) ALDH1A1KDM4EL3MBTL1KCNJ1TYR
SCHEMBL29952985 0.78 EGFR (0.33) ALDH1A1KDM4EL3MBTL1KCNJ1
SCHEMBL29958031 0.78 EGFR (0.33) ALDH1A1KDM4EL3MBTL1KCNJ1

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed