SCHEMBL2559261

SCHEMBL2559261

Cc1cc(N2CCCC(C(N)=O)C2)ccc1C=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
PKM P14618 1/20 0.47
PRKDC P78527 1/20 0.47
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 2/20 0.47
HSD17B10 Q99714 2/20 0.47
HPGD P15428 1/20 0.47
WDR91 A4D1P6 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
LMNA P02545 1/20 0.41
TNNI3 P19429 1/20 0.41
TNNT2 P45379 1/20 0.41
TNNC1 P63316 1/20 0.41
SYK P43405 3/20 0.40
PBK Q96KB5 1/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40

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
SCHEMBL15332779 0.85 NPC1 (0.51) RAB9ANPC1PKMPRKDCALDH1A1
SCHEMBL14747901 0.81 ALDH1A1 (0.49) RAB9ANPC1PRKDCALDH1A1KDM4E
SCHEMBL1911872 0.81 ZAP70 (0.49) PKMPRKDCALDH1A1KDM4EHSD17B10
SCHEMBL2557505 0.79 TRIM24 (0.54) PRKDCALDH1A1KDM4EHSD17B10WDR91
SCHEMBL6257426 0.79 ALDH1A1 (0.47) RAB9APKMPRKDCALDH1A1KDM4E
SCHEMBL2448228 0.79 WDR91 (0.51) RAB9ANPC1PRKDCALDH1A1KDM4E
SCHEMBL14637460 0.79 HPGD (0.61) ALDH1A1KDM4EHSD17B10HPGDMEN1
SCHEMBL10207986 0.78 ZAP70 (0.49) RAB9APKMPRKDCALDH1A1KDM4E
SCHEMBL12311809 0.78 ZAP70 (0.49) RAB9APKMPRKDCALDH1A1KDM4E
SCHEMBL1911888 0.78 ZAP70 (0.49) RAB9APKMPRKDCALDH1A1KDM4E

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