SCHEMBL2556856

SCHEMBL2556856

Cc1cc(C)nc(-n2nc(C(F)F)c(C=O)c2Cl)n1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 3/20 0.37
KCNN3 Q9UGI6 2/20 0.33
ALOX15 P16050 2/20 0.33
LMNA P02545 4/20 0.32
TP53 P04637 1/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
POLB P06746 1/20 0.31
NPSR1 Q6W5P4 2/20 0.31

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
SCHEMBL2558134 0.90 HTT (0.38) KDM4ETSHRHTTALOX15LMNA
SCHEMBL2560657 0.81 HTT (0.41) KDM4ETSHRHTTLMNAALDH1A1
SCHEMBL2553165 0.79 POLB (0.34) LMNAALDH1A1MAPTSMN1; SMN2POLB
SCHEMBL15331562 0.78
SCHEMBL15332768 0.77 KDM4E (0.32) KDM4EALDH1A1
SCHEMBL2558267 0.76 MAPT (0.41) KDM4EHTTLMNATP53ALDH1A1
SCHEMBL2558416 0.76 HTT (0.38) TSHRHTTALOX15ALDH1A1
SCHEMBL15330827 0.76 P2RX7 (0.34) SMN1; SMN2
SCHEMBL15332053 0.75 NPBWR1 (0.41) KDM4EHTTLMNATP53ALDH1A1
SCHEMBL2554372 0.75 CDK4 (0.36) KDM4ETSHRHTTMAPTPOLB

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