SCHEMBL2556192

SCHEMBL2556192

NC(=O)C1CCCN(c2c(F)cc(C=O)cc2F)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HSD17B10 Q99714 2/20 0.41
KDM4E B2RXH2 2/20 0.41
HPGD P15428 1/20 0.41
CDK9 P50750 1/20 0.41
FPR2 P25090 1/20 0.40
SCN9A Q15858 1/20 0.40
PBK Q96KB5 1/20 0.40
DPP4 P27487 3/20 0.38
DPP9 Q86TI2 3/20 0.38
DPP7 Q9UHL4 3/20 0.38
DPP8 Q6V1X1 2/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
PRKDC P78527 1/20 0.38
EIF2AK4 Q9P2K8 2/20 0.37
NPC1 O15118 1/20 0.36
TSHR P16473 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL2558977 0.86 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2HSD17B10KDM4EHPGD
SCHEMBL2558605 0.83 CYP3A4 (0.48) ALDH1A1SMN1; SMN2KDM4EHPGDNPC1
SCHEMBL2557505 0.77 TRIM24 (0.54) ALDH1A1SMN1; SMN2HSD17B10KDM4EPBK
SCHEMBL2561989 0.76 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2HSD17B10KDM4EHPGD
SCHEMBL15330281 0.76 AR (0.41) ALDH1A1SMN1; SMN2FPR2SCN9ADPP4
SCHEMBL2552969 0.75 PBK (0.46) ALDH1A1HSD17B10KDM4EHPGDCDK9
SCHEMBL23235276 0.75 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2KDM4EHPGDGAA
SCHEMBL18876516 0.73 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2KDM4E
SCHEMBL2450319 0.73 WDR91 (0.48) ALDH1A1HSD17B10KDM4EHPGDCDK9
SCHEMBL2556324 0.72 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2HPGDGAANPC1

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