SCHEMBL5474309

SCHEMBL5474309

CC(C)(C)OC(=O)N1CCCC(C(=O)c2ccc(N)cc2)C1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.55
KMT2A Q03164 6/20 0.55
ALDH1A1 P00352 4/20 0.55
MAPT P10636 2/20 0.55
MAPK1 P28482 1/20 0.50
ABL1 P00519 1/20 0.49
RIN1 Q13671 1/20 0.49
HPGD P15428 1/20 0.47
PLA2G1B P04054 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
USP30 Q70CQ3 1/20 0.45
RAB9A P51151 1/20 0.45
GPR119 Q8TDV5 1/20 0.45
NR1H2 P55055 1/20 0.44

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
SCHEMBL5476449 0.88 MEN1 (0.55) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL5476452 0.88 MEN1 (0.55) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL3325048 0.88 ALDH1A1 (0.58) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL969044 0.88 ALDH1A1 (0.58) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL969043 0.88 ALDH1A1 (0.58) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL24833605 0.85 MGLL (0.56) KMT2AALDH1A1MAPTMAPK1ABL1
SCHEMBL5479702 0.82 ALDH1A1 (0.52) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL5479697 0.82 ALDH1A1 (0.52) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL30736248 0.82 ABL1 (0.63) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL28192443 0.81 ALDH1A1 (0.61) MEN1KMT2AALDH1A1MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070112000-A1 Chemical compounds ASTRAZENECA R&D ALDERLEY (GB) 2007-05-17 US claimed
EP-1684757-A1 SUBSTITUTED PIPERIDINES FOR THE TREATMENT OF METABOLIC SYNDROME AstraZeneca AB (SE) 2006-08-02 EP claimed
WO-2005046685-A1 SUBSTITUTED PIPERIDINES FOR THE TREATMENT OF METABOLIC SYNDROME ASTRAZENECA AB (SE) 2005-05-26 WO claimed
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-20070112000-A1 Chemical compounds ASTRAZENECA R&D ALDERLEY (GB) 2007-05-17 US disclosed
US-7115750-B1 Melanin concentrating hormone antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-10-03 US disclosed
EP-1684757-A1 SUBSTITUTED PIPERIDINES FOR THE TREATMENT OF METABOLIC SYNDROME AstraZeneca AB (SE) 2006-08-02 EP disclosed
WO-2005046685-A1 SUBSTITUTED PIPERIDINES FOR THE TREATMENT OF METABOLIC SYNDROME ASTRAZENECA AB (SE) 2005-05-26 WO disclosed
EP-1218336-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP disclosed
WO-2001021577-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-29 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 (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-20070112000-A1 Chemical compounds HSD11B1, CYP11B1, HSD11B2 MEN1 1206/4885KMT2A 2279/4885ALDH1A1 68/4885
US-20070173498-A1 Melanin concentrating hormone antagonist MC1R, MCHR1, MCHR2 MEN1 380/4885KMT2A 1886/4885ALDH1A1 1784/4885

“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.