SCHEMBL2554827

SCHEMBL2554827

CCCC(C)NC(=O)C(C)Oc1ccc(C=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A3 P47895 1/20 0.47
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
THRB P10828 1/20 0.43
POLB P06746 1/20 0.43
ALDH1A1 P00352 5/20 0.42
KMT2A Q03164 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
HPGD P15428 1/20 0.40
ACACB O00763 2/20 0.39
GAA P10253 1/20 0.39
RECQL P46063 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
DRD1 P21728 1/20 0.38

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
SCHEMBL29954060 0.89 ALDH1A3 (0.50) ALDH1A3SMN1; SMN2ALDH1A1KMT2ATAS1R3
SCHEMBL2557928 0.86 ALDH1A1 (0.47) LMNASMN1; SMN2THRBPOLBALDH1A1
SCHEMBL2562992 0.83 ALDH1A3 (0.50) ALDH1A3SMN1; SMN2ALDH1A1KMT2ATAS1R3
SCHEMBL2557252 0.83 ALDH1A3 (0.56) ALDH1A3LMNAALDH1A1HPGDGAA
SCHEMBL29955755 0.81 GAA (0.52) ALDH1A3SMN1; SMN2THRBPOLBALDH1A1
SCHEMBL15333466 0.81 ALDH1A3 (0.50) ALDH1A3LMNASMN1; SMN2THRBPOLB
SCHEMBL29955555 0.80 ALDH1A3 (0.53) ALDH1A3SMN1; SMN2POLBALDH1A1KMT2A
SCHEMBL2557734 0.78 SMN1; SMN2 (0.70) LMNASMN1; SMN2THRBPOLBALDH1A1
SCHEMBL2558483 0.78 ALDH1A3 (0.58) ALDH1A3LMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL15331876 0.77 GAA (0.51) ALDH1A3SMN1; SMN2ALDH1A1KMT2AGAA

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 7 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
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed