SCHEMBL9861601

SCHEMBL9861601

C=CC=CC(C#N)=C(C=Cc1ccccc1)C=C(C#N)C=Cc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
MCL1 Q07820 1/20 0.34
LMNA P02545 5/20 0.33
MAPT P10636 4/20 0.33
ALDH1A1 P00352 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HDAC3 O15379 2/20 0.33
HDAC4 P56524 2/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC2 Q92769 2/20 0.33
HDAC8 Q9BY41 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
PLIN1 O60240 2/20 0.33
RECQL P46063 2/20 0.33
PLIN5 Q00G26 2/20 0.33
ABHD5 Q8WTS1 2/20 0.33
TNKS O95271 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC10 Q969S8 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
SCHEMBL10901492 0.89 KDM4E (0.34) KDM4EMCL1LMNAMAPTALDH1A1
SCHEMBL11031369 0.82 KDM4E (0.35) KDM4EMCL1LMNAMAPTALDH1A1
SCHEMBL10905612 0.82 GLA (0.41) KDM4EMCL1LMNAMAPTALDH1A1
SCHEMBL9190659 0.81 KDM4E (0.38) KDM4EMCL1LMNAMAPTALDH1A1
SCHEMBL15064807 0.80 HDAC3 (0.49) KDM4EMCL1LMNAMAPTALDH1A1
SCHEMBL2246620 0.78 HDAC3 (0.47) KDM4EMCL1LMNAMAPTALDH1A1
SCHEMBL6053030 0.77 GLA (0.42) KDM4EMCL1LMNAMAPTALDH1A1
SCHEMBL6518213 0.77 LMNA (0.39) KDM4EMCL1LMNAMAPTALDH1A1
SCHEMBL8972957 0.75 GLA (0.36) KDM4EMCL1LMNAMAPTALDH1A1
SCHEMBL24648539 0.75 LMNA (0.42) KDM4EMCL1LMNAMAPTALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0176604-B1 HIGH-MOLECULAR PIPERIDINE GROUPS CONTAINED IN ESTERS, PROCESS FOR THEIR PREPARATION, THEIR USE AS STABILISERS FOR POLYMERS AND POLYMERS CONTAINING THEM HOECHST AKTIENGESELLSCHAFT (DE) 1991-06-12 EP disclosed