SCHEMBL5657971

SCHEMBL5657971

CCOc1ccccc1N(CCN1CCN(c2cccc(C)c2)CC1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 4/20 0.50
MAPT P10636 3/20 0.49
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 1/20 0.49
HTR1A P08908 4/20 0.48
HTR7 P34969 3/20 0.48
OPRM1 P35372 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
RAB9A P51151 2/20 0.45
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45
DRD3 P35462 3/20 0.44
DRD2 P14416 2/20 0.44
DRD4 P21917 1/20 0.44
HTR2A P28223 2/20 0.42
HTR2C P28335 2/20 0.42

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
SCHEMBL5656018 0.94 KCNH2 (0.54) KCNH2MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL5657837 0.91 HTR1A (0.56) MAPTLMNAALDH1A1HTR1AHTR7
SCHEMBL5656134 0.90 HTR1A (0.48) MAPTLMNASMN1; SMN2HTR1AHTR7
SCHEMBL5657779 0.90 HTR1A (0.59) MAPTLMNASMN1; SMN2HTR1AHTR7
SCHEMBL5656003 0.90 KCNH2 (0.52) KCNH2MAPTHTR1AHTR7MEN1
SCHEMBL5656201 0.89 HTR1A (0.55) KCNH2MAPTHTR1AHTR7MEN1
SCHEMBL5655950 0.89 HTR1A (0.50) KCNH2MAPTHTR1AHTR7OPRM1
SCHEMBL5656230 0.86 HTR7 (0.53) MAPTLMNAALDH1A1HTR1AHTR7
SCHEMBL5656238 0.86 HTR7 (0.53) MAPTLMNAALDH1A1HTR1AHTR7
SCHEMBL5654667 0.86 HTR7 (0.53) KCNH2MAPTHTR1AHTR7HTR2A

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-20040058933-A1 Aryl carbamate derivatives, preperation and use thereof CEREP (FR) 2004-03-25 US claimed
US-7238693-B2 Aryl carbamate derivatives, preparation and use thereof CEREP (FR) 2007-07-03 US disclosed
US-20040058933-A1 Aryl carbamate derivatives, preperation and use thereof CEREP (FR) 2004-03-25 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-20040058933-A1 Aryl carbamate derivatives, preperation and use thereof HTR4, HTR5A, HTR3C KCNH2 1144/4885MAPT 3644/4885LMNA 1137/4885

“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.