SCHEMBL673024

SCHEMBL673024

CCN(CC)CCN=Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
KMT2A Q03164 3/20 0.47
HPGD P15428 2/20 0.47
MEN1 O00255 2/20 0.47
CA2 P00918 2/20 0.46
TAAR1 Q96RJ0 1/20 0.41
SIGMAR1 Q99720 2/20 0.41
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA9 Q16790 1/20 0.40
TSHR P16473 1/20 0.40
CHRM2 P08172 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
CHRM1 P11229 1/20 0.39
DRD1 P21728 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39

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
SCHEMBL4891588 0.88 CA2 (0.52) ALDH1A1KMT2AHPGDMEN1CA2
SCHEMBL16073014 0.88 CA2 (0.52) ALDH1A1KMT2AHPGDMEN1CA2
SCHEMBL674665 0.88 SIGMAR1 (0.49) ALDH1A1KMT2AHPGDMEN1CA2
SCHEMBL23890392 0.84 CA2 (0.45) ALDH1A1KMT2AHPGDMEN1CA2
SCHEMBL8636418 0.81 L3MBTL1 (0.43) ALDH1A1KMT2AMEN1CA2TAAR1
SCHEMBL11558089 0.81 CA2 (0.49) ALDH1A1KMT2AMEN1CA2TAAR1
SCHEMBL673967 0.81 CA2 (0.49) ALDH1A1KMT2AMEN1CA2TAAR1
SCHEMBL15804410 0.80 KMT2A (0.44) ALDH1A1KMT2AHPGDMEN1CA2
SCHEMBL5235095 0.78 KMT2A (0.64) ALDH1A1KMT2AMEN1CA2TAAR1
SCHEMBL7911619 0.78 KMT2A (0.64) ALDH1A1KMT2AMEN1CA2TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1873168-B1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES BRIDGESTONE CORP (JP) 2012-12-12 EP disclosed
US-7968652-B2 Modified conjugated diene copolymer, rubber compositions and tires BRIDGESTONE CORPORATION (JP) 2011-06-28 US disclosed
US-20090292043-A1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES BRIDGESTONE CORPORATION (JP) 2009-11-26 US disclosed
EP-1873168-A1 MODIFIED CONJUGATED DIENE COPOLYMER, RUBBER COMPOSITIONS AND TIRES Bridgestone Corporation (JP) 2008-01-02 EP disclosed