SCHEMBL2560980

SCHEMBL2560980

NC(=O)C1CCN(c2ccc(F)cc2C=O)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
MAPT P10636 3/20 0.48
CYP3A4 P08684 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
POLB P06746 1/20 0.48
SMN1; SMN2 Q16637 5/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 2/20 0.44
GAA P10253 1/20 0.44
SCN9A Q15858 1/20 0.42
NOTUM Q6P988 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ABL1 P00519 1/20 0.41
LMNA P02545 1/20 0.41
HSD11B1 P28845 1/20 0.41

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
SCHEMBL2552969 0.84 PBK (0.46) ALDH1A1GAASCN9AKDM4EHSD11B1
SCHEMBL2557591 0.83 FFAR4 (0.41) ALDH1A1GAA
SCHEMBL2553207 0.82 CYP46A1 (0.45) ALDH1A1MAPTPOLBSMN1; SMN2L3MBTL1
SCHEMBL2554368 0.81 GAA (0.53) ALDH1A1MAPTCYP3A4POLBSMN1; SMN2
SCHEMBL7814266 0.81 SMN1; SMN2 (0.62) ALDH1A1MAPTCYP3A4CYP1A2CYP2D6
SCHEMBL2556324 0.81 ALDH1A1 (0.62) ALDH1A1MAPTCYP3A4CYP1A2CYP2D6
SCHEMBL22781025 0.80 BPTF (0.48) ALDH1A1SMN1; SMN2L3MBTL1GAA
SCHEMBL28464943 0.80 ALDH1A1 (0.56) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL28643265 0.79 HDAC3 (0.39) MAPT
SCHEMBL18064770 0.78 L3MBTL1 (0.62) ALDH1A1MAPTCYP3A4CYP1A2CYP2D6

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