SCHEMBL6705900

SCHEMBL6705900

CCN(CC)Cc1ccc(CCNC(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
HRH3 Q9Y5N1 1/20 0.48
MCHR1 Q99705 1/20 0.48
ESRRG P62508 2/20 0.46
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.45
F13A1 P00488 1/20 0.45
MEN1 O00255 1/20 0.45
RAB9A P51151 1/20 0.45
GAA P10253 1/20 0.44
GLA P06280 1/20 0.44
ESRRB O95718 1/20 0.43
PLAAT3 P53816 1/20 0.43
PLAAT5 Q96KN8 1/20 0.43
PLAAT2 Q9NWW9 1/20 0.43
PLAAT4 Q9UL19 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43

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
SCHEMBL7702871 0.82 ESRRG (0.68) HDAC8HDAC6MCHR1ESRRGKMT2A
SCHEMBL4511148 0.80 KDM4E (0.52) ESRRGKMT2AKDM4EF13A1RAB9A
SCHEMBL4584283 0.78 NPC1 (0.64) KMT2AKDM4EF13A1RAB9APLAAT3
SCHEMBL23291261 0.78 CYP1A2 (0.56) HRH3KMT2AMEN1RAB9A
SCHEMBL23928194 0.77 BCHE (0.54) HRH3KMT2AMEN1RAB9AGAA
SCHEMBL6223178 0.77 HRH3 (0.57) HDAC8HDAC6HRH3KDM4E
SCHEMBL3236518 0.77 CA12 (0.47) KDM4EF13A1RAB9APLAAT3PLAAT5
Phenethylcarbamic Acid SCHEMBL31010705 0.75 ALDH1A1 (0.52) ESRRGKMT2AMEN1RAB9AGLA
SCHEMBL6706744 0.75 MCHR1 (0.81) HDAC8HDAC6MCHR1ESRRGKMT2A
SCHEMBL23928207 0.75 NPC1 (0.47) KMT2AKDM4EF13A1MEN1RAB9A

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-20040242572-A1 New carboxamide compounds having melanin concentrating hormone antagonistic activity, pharmaceutical preparations comprising these compounds and process for their manufacture BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2004-12-02 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-20040242572-A1 New carboxamide compounds having melanin concentrating hormone antagonistic activity, pharmaceutical preparations comprising these compounds and process for their manufacture MCHR2, MCHR1, NPY1R HDAC8 2731/4885HDAC6 1802/4885HRH3 254/4885

“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.