SCHEMBL17124808

SCHEMBL17124808

COCCCCOCCCCOCCCCc1cc(C)ccc1C

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.49
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 3/20 0.36
L3MBTL1 Q9Y468 4/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
TACR1 P25103 1/20 0.35
TSHR P16473 1/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
HPGD P15428 1/20 0.34
MAPT P10636 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 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
SCHEMBL17124805 0.85 TAAR1 (0.47) TAAR1ALDH1A1KDM4EL3MBTL1SMN1; SMN2
SCHEMBL10111039 0.84 TAAR1 (0.53) TAAR1ALDH1A1KDM4EL3MBTL1SMN1; SMN2
SCHEMBL8427287 0.82 TAAR1 (0.59) TAAR1ALDH1A1KDM4EL3MBTL1TACR1
SCHEMBL17679924 0.81 TAAR1 (0.50) TAAR1ALDH1A1KDM4EL3MBTL1SMN1; SMN2
SCHEMBL20251355 0.79 TAAR1 (0.47) TAAR1ALDH1A1KDM4EL3MBTL1SMN1; SMN2
SCHEMBL26442186 0.79 TAAR1 (0.47) TAAR1ALDH1A1KDM4EL3MBTL1SMN1; SMN2
SCHEMBL8750457 0.79 KDM4E (0.42) TAAR1ALDH1A1KDM4EL3MBTL1SMN1; SMN2
SCHEMBL17124806 0.78 TSHR (0.57) ALDH1A1KDM4EL3MBTL1SMN1; SMN2TSHR
SCHEMBL2811599 0.78 KDM4E (0.43) TAAR1ALDH1A1KDM4EL3MBTL1SMN1; SMN2
SCHEMBL10173843 0.78 TAAR1 (0.50) TAAR1SMN1; SMN2TACR1TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9758688-B2 Composition for forming conductive film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-09-12 US disclosed
US-20150275015-A1 COMPOSITION FOR FORMING CONDUCTIVE FILM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-01 US disclosed