SCHEMBL1543260

SCHEMBL1543260

O=C(C1CC1)C1CCC(N(Cc2ccccc2)Cc2ccccc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
YTHDC1 Q96MU7 1/20 0.51
ALDH1A1 P00352 3/20 0.46
OPRM1 P35372 3/20 0.45
SLC6A2 P23975 2/20 0.44
SLC6A4 P31645 2/20 0.44
ACKR3 P25106 1/20 0.43
DPP8 Q6V1X1 1/20 0.43
DPP7 Q9UHL4 1/20 0.43
CCR5 P51681 1/20 0.43
KDM4E B2RXH2 2/20 0.41
HTT P42858 2/20 0.41
GAA P10253 1/20 0.41
ALOX12 P18054 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SLC6A3 Q01959 1/20 0.41
AGER Q15109 2/20 0.40

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
SCHEMBL21222573 1.00 MEN1 (0.54) MEN1KMT2AYTHDC1ALDH1A1OPRM1
SCHEMBL27819057 0.90 MEN1 (0.51) MEN1KMT2AYTHDC1ALDH1A1OPRM1
SCHEMBL27838789 0.90 MEN1 (0.51) MEN1KMT2AYTHDC1ALDH1A1OPRM1
SCHEMBL1934571 0.90 MEN1 (0.54) MEN1KMT2AYTHDC1ALDH1A1OPRM1
SCHEMBL12282446 0.90 MEN1 (0.54) MEN1KMT2AYTHDC1ALDH1A1OPRM1
Hydrochloric Acid SCHEMBL1543195 0.88 MEN1 (0.53) MEN1KMT2AYTHDC1ALDH1A1OPRM1
Hydrochloric Acid SCHEMBL1543198 0.88 MEN1 (0.53) MEN1KMT2AYTHDC1ALDH1A1OPRM1
SCHEMBL1933310 0.87 MEN1 (0.51) MEN1KMT2AYTHDC1ALDH1A1OPRM1
SCHEMBL16216060 0.87 MEN1 (0.51) MEN1KMT2AYTHDC1ALDH1A1OPRM1
SCHEMBL27889749 0.87 MEN1 (0.51) MEN1KMT2AYTHDC1ALDH1A1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11053234-B2 1,3 di-substituted cyclobutane or azetidine derivatives as hematopoietic prostaglandin D synthase inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2021-07-06 US disclosed
US-20190241554-A1 1,3 DI-SUBSTITUTED CYCLOBUTANE OR AZETIDINE DERIVATIVES AS HEMATOPOIETIC PROSTAGLANDIN D SYNTHASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-08-08 US disclosed
EP-2307377-A1 NICOTINAMIDE DERIVATIVES Pfizer Limited (GB) 2011-04-13 EP disclosed
US-20100173888-A1 Nicotinamide Derivatives PFIZER INC 2010-07-08 US disclosed
WO-2009153720-A1 NICOTINAMIDE DERIVATIVES PFIZER LIMITED (GB) 2009-12-23 WO 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 (3 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-11053234-B2 1,3 di-substituted cyclobutane or azetidine derivatives as hematopoietic prostaglandin D synthase inhibitors HPGDS, PTGDR, PTGER1 MEN1 3899/4885KMT2A 2562/4885YTHDC1 2832/4885
US-20190241554-A1 1,3 DI-SUBSTITUTED CYCLOBUTANE OR AZETIDINE DERIVATIVES AS HEMATOPOIETIC PROSTAGLANDIN D SYNTHASE INHIBITORS HPGDS, PTGDR, PTGER1 MEN1 3899/4885KMT2A 2562/4885YTHDC1 2832/4885
US-20100173888-A1 Nicotinamide Derivatives NNT, NAMPT, NQO1 MEN1 2257/4885KMT2A 3206/4885YTHDC1 4862/4885

“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.