SCHEMBL2560489

SCHEMBL2560489

CC1CCCC(Oc2ccc(C=O)cc2)(C(=O)O)C1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.35
ALDH1A1 P00352 4/20 0.35
CYP2A6 P11509 1/20 0.35
TRPM8 Q7Z2W7 1/20 0.34
KMT2A Q03164 2/20 0.33
MAP4K4 O95819 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PARP10 Q53GL7 1/20 0.33
PARP3 Q9Y6F1 1/20 0.33
ALDH1A3 P47895 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
SCHEMBL2556307 0.85 SRC (0.37) ALDH1A1KMT2A
SCHEMBL15332456 0.84 ALDH1A1 (0.39) ALDH1A1CYP2A6TRPM8KMT2AMAP4K4
SCHEMBL2563548 0.82 MAP4K4 (0.43) ALDH1A1CYP2A6KMT2AMAP4K4KDM4E
SCHEMBL2562466 0.81 MAP4K4 (0.43) ALDH1A1CYP2A6KMT2AMAP4K4KDM4E
SCHEMBL2557088 0.75 MAP4K4 (0.37) ALDH1A1CYP2A6KMT2AMAP4K4KDM4E
SCHEMBL2553965 0.74 ALDH1A1 (0.38) ALDH1A1CYP2A6TRPM8KMT2AKDM4E
SCHEMBL2558816 0.74 ALDH1A1 (0.46) ALDH1A1CYP2A6KMT2AMAP4K4KDM4E
SCHEMBL2562277 0.72 KMT2A (0.38) ALDH1A1CYP2A6KMT2AMAP4K4KDM4E
SCHEMBL6358099 0.72 ALDH1A1 (0.39) ALDH1A1KMT2AKDM4E
SCHEMBL2556961 0.69 SRC (0.40) ALDH1A1KMT2AKDM4E

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