SCHEMBL12377594

SCHEMBL12377594

CCN(C=C(c1ccccc1)c1ccccc1)CC=CC=C(C)C

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
PGR P06401 1/20 0.30
ADRA2A P08913 1/20 0.30
ADRA2B P18089 1/20 0.30
HTR2A P28223 1/20 0.30
HRH1 P35367 1/20 0.30
KCNH2 Q12809 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL12377596 0.90 MTNR1A (0.33) MTNR1AMTNR1BALDH1A1
SCHEMBL12377595 0.82 MTNR1A (0.34) MTNR1AMTNR1BALDH1A1
SCHEMBL12422795 0.79 ALDH1A1 (0.40) MTNR1AMTNR1BSMN1; SMN2MEN1KMT2A
SCHEMBL9153310 0.69 ALDH1A1 (0.36) MTNR1AMTNR1BSMN1; SMN2MEN1KMT2A
SCHEMBL28005546 0.69 SIGMAR1 (0.38) MTNR1AMTNR1BSMN1; SMN2KMT2AALDH1A1
SCHEMBL136255 0.67 ALDH1A1 (0.39) SMN1; SMN2MEN1KMT2ANPSR1ALDH1A1
SCHEMBL19803812 0.67 ALDH1A1 (0.39) SMN1; SMN2MEN1KMT2ANPSR1ALDH1A1
SCHEMBL44266 0.65 MTNR1A (0.42) MTNR1AMTNR1BNPSR1ALDH1A1
SCHEMBL8773436 0.65 CYP1A2 (0.43) SMN1; SMN2MEN1KMT2AALDH1A1HPGD
SCHEMBL28005578 0.64 AOC3 (0.41) MTNR1AMTNR1BNPSR1ALDH1A1PGR

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-8003287-B2 Low temperature charge transportability and potential, sensitivity and photoresponsiveness; durability SHARP KABUSHIKI KAISHA (JP) 2011-08-23 US disclosed
US-20080166642-A1 Electrophotographic photoconductor and image-forming apparatus SHARP KABUSHIKI KAISHA (JP) 2008-07-10 US disclosed