SCHEMBL2555933

SCHEMBL2555933

CNC(=O)CN(C)c1ccc(C=O)cc1C

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A3 P47895 5/20 0.38
ALDH3A1 P30838 4/20 0.36
NOTUM Q6P988 2/20 0.36
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
POLB P06746 1/20 0.33
BRD4 O60885 1/20 0.33

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
SCHEMBL29954099 0.86 ALDH1A3 (0.49) ALDH1A1SMN1; SMN2ALDH1A3ALDH3A1KDM4E
SCHEMBL29956220 0.86 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2ALDH1A3ALDH3A1NOTUM
SCHEMBL2559087 0.86 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2ALDH1A3ALDH3A1KDM4E
SCHEMBL2559335 0.85 ALDH1A1 (0.39) ALDH1A1ALDH1A3ALDH3A1NOTUMKDM4E
SCHEMBL2561228 0.83 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2ALDH1A3ALDH3A1NOTUM
SCHEMBL2560265 0.83 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2ALDH1A3ALDH3A1KDM4E
SCHEMBL29952559 0.82 MAOA (0.43) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL2562764 0.82 ALDH1A1 (0.40) ALDH1A1ALDH1A3ALDH3A1KDM4E
SCHEMBL2559147 0.81 ALDH3A1 (0.56) ALDH1A1SMN1; SMN2ALDH3A1KDM4EMEN1
SCHEMBL2561793 0.80 HPGD (0.43) ALDH1A1KDM4EMEN1KMT2APOLB

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