SCHEMBL18930348

SCHEMBL18930348

CCC(C)C(=O)C(c1ccccc1)N(CC)C(C)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 3/20 0.39
HSD17B10 Q99714 1/20 0.39
PGR P06401 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
HTR2A P28223 1/20 0.38
HRH1 P35367 1/20 0.38
KCNH2 Q12809 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
LTB4R Q15722 3/20 0.38
LTB4R2 Q9NPC1 3/20 0.38
GLA P06280 1/20 0.38
HPGD P15428 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
SCHEMBL10298817 0.87 PGR (0.40) NPY5RTRPM8MEN1KMT2ALMNA
SCHEMBL8535379 0.82 HTR2A (0.44) TRPM8LMNAHTR2AHRH1GLA
SCHEMBL628344 0.82 NR1H2 (0.47) TRPM8LMNACHRM2CHRM4CHRM1
SCHEMBL27855089 0.82 NR1H2 (0.47) TRPM8LMNACHRM2CHRM4CHRM1
SCHEMBL12292188 0.79 ALDH1A1 (0.43) NPY5RTRPM8MEN1KMT2ALMNA
SCHEMBL2756116 0.78 HPGD (0.40) NPY5RTRPM8MEN1KMT2ALMNA
SCHEMBL13179219 0.77 OPRD1 (0.41) NPY5RTRPM8MEN1KMT2ALMNA
SCHEMBL11929029 0.74 MEN1 (0.47) MEN1KMT2ALMNAHSD17B10CHRM2
SCHEMBL23135687 0.73 LMNA (0.52) MEN1KMT2ALMNAHSD17B10HPGD
SCHEMBL627471 0.73 CYP1A2 (0.41) LMNAAOC3NR1H2NR1H3CYP1A2

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-10039754-B2 Anti-viral compounds ABBVIE INC. (US) 2018-08-07 US disclosed
US-20170157104-A1 Anti-Viral Compounds ABBVIE INC. (US) 2017-06-08 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 (2 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-20170157104-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS NPY5R 4862/4885TRPM8 3749/4885MEN1 4681/4885
US-10039754-B2 Anti-viral compounds HAVCR2, EIF2AK2, MAVS NPY5R 4862/4885TRPM8 3749/4885MEN1 4681/4885

“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.