SCHEMBL3819937

SCHEMBL3819937

CN(Cc1ccc(C(=O)N2CCCC3CCCC=C32)cc1)C(=O)N(C)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 2/20 0.39
AVPR1A P37288 2/20 0.39
KCNH2 Q12809 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
CPT2 P23786 1/20 0.39
CPT1A P50416 1/20 0.39
PKM P14618 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.37
LMNA P02545 2/20 0.36
HPGD P15428 1/20 0.36
HIF1A Q16665 1/20 0.36
OXTR P30559 1/20 0.36
HSD11B1 P28845 1/20 0.36

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
SCHEMBL3810932 0.87 HDAC1 (0.47) PKMHTTSMN1; SMN2
SCHEMBL3809230 0.83 HRH3 (0.39) KCNH2HRH3SMN1; SMN2ALDH1A1LMNA
SCHEMBL3456155 0.79 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1POLBLMNAHPGD
SCHEMBL3815128 0.79 GRIA2 (0.36) AVPR2AVPR1AKCNH2HRH3SMN1; SMN2
SCHEMBL3814550 0.78 CCR5 (0.43) HRH3PKMHTTSMN1; SMN2ALDH1A1
SCHEMBL3808812 0.78 AOC3 (0.39) HRH3HTTSMN1; SMN2ALDH1A1POLB
SCHEMBL3811382 0.78 KMT2A (0.43) HTTALDH1A1HPGD
SCHEMBL3813715 0.78 HPGD (0.54) HRH3SMN1; SMN2ALDH1A1LMNAHPGD
SCHEMBL3819938 0.77 HSD11B1 (0.53) KCNH2HRH3CPT2CPT1ASMN1; SMN2
SCHEMBL3811229 0.76 NSD2 (0.41) POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090124598-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HIGH POINT PHARMACEUTICALS, LLC 2009-05-14 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-20090124598-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HSD11B1, HSD11B2, HSD3B1 AVPR2 861/4885AVPR1A 878/4885KCNH2 4696/4885

“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.