SCHEMBL847408

SCHEMBL847408

CC(=O)NC(Cc1ccc(Cl)cc1)C(=O)NCCN1CCOCC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 10/20 0.58
ALDH1A1 P00352 2/20 0.56
HTR1A P08908 1/20 0.56
MAOA P21397 1/20 0.56
MAOB P27338 1/20 0.56
KCNH2 Q12809 1/20 0.56
CD274 Q9NZQ7 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.54
CNR1 P21554 1/20 0.54
NPSR1 Q6W5P4 1/20 0.53
RAB9A P51151 1/20 0.51
LMNA P02545 1/20 0.50
KMT2A Q03164 1/20 0.50
ACACB O00763 1/20 0.49
EPHX2 P34913 1/20 0.49

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
SCHEMBL7035814 0.85 ALDH1A1 (0.62) ALDH1A1HTR1AMAOAMAOBKCNH2
SCHEMBL14295176 0.82 ALDH1A1 (0.54) TACR2ALDH1A1HTR1AMAOAMAOB
SCHEMBL681503 0.78 ALDH1A1 (0.52) TACR2ALDH1A1HTR1AMAOAMAOB
SCHEMBL10266645 0.77 ALDH1A1 (0.54) TACR2ALDH1A1HTR1AMAOAMAOB
SCHEMBL13159588 0.75 AKT1 (0.67) TACR2
SCHEMBL14032215 0.74 POLB (0.53) TACR2ALDH1A1HTR1AMAOAMAOB
SCHEMBL18492849 0.74 LMNA (0.59) TACR2CD274SMN1; SMN2LMNAKMT2A
SCHEMBL7287023 0.73 MEN1 (0.60) TACR2CD274LMNAKMT2A
SCHEMBL12310426 0.73 MEN1 (0.60) TACR2CD274LMNAKMT2A
SCHEMBL5408370 0.73 TACR2 (0.74) TACR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143446-B2 Substituted acrylamide derivative and pharmaceutical composition comprising the same DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-03-27 US disclosed
US-8143446-B2 Substituted acrylamide derivative and pharmaceutical composition comprising the same DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-03-27 US disclosed
US-20090118199-A1 SUBSTITUTED ACRYLAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DAIICHI SANKYO COMPANY , LIMITED (JP) 2009-05-07 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-20090118199-A1 SUBSTITUTED ACRYLAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME ACR, NAT1, C1S TACR2 2330/4885ALDH1A1 75/4885HTR1A 38/4885

“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.