SCHEMBL2555836

SCHEMBL2555836

CC(C)CCOCCCC=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.38
TSHR P16473 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.32
FAAH O00519 2/20 0.31
TRPV1 Q8NER1 1/20 0.31
PRKCA P17252 1/20 0.30
ADH1B P00325 1/20 0.30
ADH1C P00326 1/20 0.30
ADH1A P07327 1/20 0.30

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
SCHEMBL216686 0.91 HIF1A (0.38) HIF1ATSHRTDP1ALDH1A1MAPT
SCHEMBL215747 0.89 HIF1A (0.36) HIF1ATSHRALDH1A1MAPTFAAH
SCHEMBL2558988 0.86 ALDH1A1 (0.39) TSHRTDP1ALDH1A1ADH1BADH1C
SCHEMBL17987840 0.84 ALDH1A1 (0.38) TSHRTDP1ALDH1A1ADH1BADH1C
SCHEMBL22564681 0.84 ALDH1A1 (0.38) TSHRTDP1ALDH1A1ADH1BADH1C
SCHEMBL24624963 0.84 ALDH1A1 (0.38) TSHRTDP1ALDH1A1ADH1BADH1C
SCHEMBL26552326 0.84 ALDH1A1 (0.38) TSHRTDP1ALDH1A1ADH1BADH1C
SCHEMBL29950792 0.83 ALDH1A1 (0.32) HIF1ATSHRTDP1ALDH1A1ADH1B
SCHEMBL6545092 0.81 HIF1A (0.56) HIF1ATSHRTDP1ALDH1A1MAPT
SCHEMBL27200274 0.80 TSHR (0.41) HIF1ATSHRALDH1A1MAPTFAAH

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