SCHEMBL12422795

SCHEMBL12422795

CCN(C=C(c1ccccc1)c1ccccc1)CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
HPGD P15428 2/20 0.40
MAPT P10636 2/20 0.40
PGR P06401 1/20 0.40
ADRA2A P08913 1/20 0.40
ADRA2B P18089 1/20 0.40
HTR2A P28223 1/20 0.40
HRH1 P35367 1/20 0.40
KCNH2 Q12809 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
ATM Q13315 1/20 0.39
HSP90AA1 P07900 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CES2 O00748 1/20 0.38

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
SCHEMBL28005546 0.83 SIGMAR1 (0.38) ALDH1A1HPGDMAPTSMN1; SMN2KMT2A
SCHEMBL19803812 0.81 ALDH1A1 (0.39) ALDH1A1HPGDPGRADRA2AADRA2B
SCHEMBL136255 0.81 ALDH1A1 (0.39) ALDH1A1HPGDPGRADRA2AADRA2B
SCHEMBL2277485 0.79 ALDH1A1 (0.38) ALDH1A1HPGDMAPTPGRADRA2A
SCHEMBL12377594 0.79 MTNR1A (0.33) ALDH1A1HPGDPGRADRA2AADRA2B
SCHEMBL28005578 0.78 AOC3 (0.41) ALDH1A1MAPTPGRADRA2AADRA2B
SCHEMBL12422791 0.77 G6PC1 (0.43) ALDH1A1MEN1KMT2ASIGMAR1TSHR
SCHEMBL9153310 0.76 ALDH1A1 (0.36) ALDH1A1HPGDMAPTPGRADRA2A
SCHEMBL8773436 0.75 CYP1A2 (0.43) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL19041280 0.75 CES2 (0.53) ALDH1A1HPGDMAPTPGRADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103958600-B Rubber composition, rubber elastomer, tire and block copolymer JSR株式会社 2016-08-24 CN disclosed
CN-104334629-B Rubber composition for tire tread and pneumatic tire 住友橡胶工业株式会社 2016-08-24 CN disclosed
CN-102958991-B Rubber combination, its manufacture method and tire JSR CORP. (JP) 2016-03-16 CN disclosed
CN-104334629-A Tread rubber composition and pneumatic tire SUMITOMO RUBBER IND 2015-02-04 CN disclosed
US-7977020-B2 Electrophotographic photoreceptor containing enamine compound, image formation apparatus provided with the same, enamine compound and method for producing the same SHARP KABUSHIKI KAISHA (JP) 2011-07-12 US disclosed
US-20080286671-A1 Electrophotographic photoreceptor containing enamine compound, image formation apparatus provided with the same, enamine compound and method for producing the same SHARP KABUSHIKI KAISHA (JP) 2008-11-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080286671-A1 Electrophotographic photoreceptor containing enamine compound, image formation apparatus provided with the same, enamine compound and method for producing the same SLC1A2, SLC1A1, SLC18A1 ALDH1A1 869/4885HPGD 596/4885MAPT 1322/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.