SCHEMBL2227496

SCHEMBL2227496

C1=CCC(N2CCCC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 10/20 0.39
L3MBTL1 Q9Y468 9/20 0.39
KDM4E B2RXH2 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MBTD1 Q05BQ5 5/20 0.35
HTR6 P50406 1/20 0.34
TP53BP1 Q12888 2/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33
L3MBTL4 Q8NA19 1/20 0.33
POLB P06746 1/20 0.33
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
FYN P06241 1/20 0.32

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
SCHEMBL14838336 0.98 KDM4E (0.41) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL2227575 0.98 KDM4E (0.41) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL19312789 0.86 HTR6 (0.41) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL19312856 0.85 L3MBTL3 (0.46) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL2228963 0.82 L3MBTL3 (0.41) L3MBTL3L3MBTL1MBTD1HTR6TP53BP1
SCHEMBL14371441 0.80 KDM4E (0.36) L3MBTL3L3MBTL1KDM4ETDP1ALDH1A1
SCHEMBL6704503 0.80 SMN1; SMN2 (0.40) L3MBTL3L3MBTL1KDM4ETDP1ALDH1A1
SCHEMBL738309 0.80 L3MBTL3 (0.41) L3MBTL3L3MBTL1MBTD1HTR6TP53BP1
SCHEMBL2228357 0.79 FYN (0.41) L3MBTL3L3MBTL1KDM4EMBTD1HTR6
SCHEMBL22639458 0.79 L3MBTL3 (0.42) L3MBTL3L3MBTL1KDM4ETDP1MBTD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2382240-A2 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP Bridgestone Corporation (JP) 2011-11-02 EP disclosed
WO-2011091346-A2 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2011-07-28 WO disclosed
WO-2010085622-A9 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2010-12-23 WO disclosed
WO-2010085622-A2 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2010-07-29 WO disclosed
US-4031136-A Process for the preparation of trans, trans-muconic acid HOECHST AKTIENGESELLSCHAFT (DT) 1977-06-21 US disclosed