SCHEMBL1709277

SCHEMBL1709277

CCC(=O)NCCC(c1ccccc1)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.72
MTNR1B P49286 3/20 0.72
CNR1 P21554 9/20 0.68
CNR2 P34972 8/20 0.62
EPHX2 P34913 4/20 0.62
CASR P41180 2/20 0.59

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
SCHEMBL26262860 0.86 MTNR1A (0.57) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL2427167 0.84 CNR1 (0.70) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL9274180 0.82 ASAH1 (0.63) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL1321256 0.82 CNR1 (0.68) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL4219824 0.81 MTNR1A (1.00) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL11196501 0.81 MTNR1A (0.52) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL2726416 0.81 MTNR1A (0.72) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL7823738 0.81 CNR1 (0.66) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL5468000 0.79 CNR1 (0.64) MTNR1AMTNR1BCNR1CNR2EPHX2
SCHEMBL8248986 0.79 CNR1 (0.72) MTNR1AMTNR1BCNR1CNR2EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023173618-A1 CYCLIC GD (III) COMPLEX, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 国科温州研究院(温州生物材料与工程研究所) 2023-09-21 WO disclosed
US-9682996-B2 Alpha helix mimetic compositions for treating cancer and other CBP/catenin-mediated diseases and conditions Prism BioLab Co., Ltd. (JP) 2017-06-20 US disclosed
US-20150376204-A1 ALPHA HELIX MIMETIC COMPOSITIONS FOR TREATING CANCER AND OTHER CBP/CATENIN-MEDIATED DISEASES AND CONDITIONS Prism BioLab Co., Ltd. (JP) 2015-12-31 US disclosed
US-9126981-B2 Alpha helix mimetic compositions for treating cancer and other CBP/catenin-mediated diseases and conditions Prism BioLab Co., Ltd. (JP) 2015-09-08 US disclosed
US-20140221657-A1 ALPHA HELIX MIMETIC COMPOSITIONS FOR TREATING CANCER AND OTHER CBP/CATENIN-MEDIATED DISEASES AND CONDITIONS PRISM BIOLAB CORPORATION (JP) 2014-08-07 US disclosed
US-20120088770-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CORPORATION (JP) 2012-04-12 US disclosed
US-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors FLECK ROMAN WOLFGANG 2009-09-10 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 (4 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-20120088770-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PLOD3, COL1A1, THPO MTNR1A 779/4885MTNR1B 1504/4885CNR1 4323/4885
US-20090227588-A1 Substituted pyrazole compounds useful as soluble epoxide hyrolase inhibitors EPHX1, EPHX2, EPX MTNR1A 4619/4885MTNR1B 4361/4885CNR1 2227/4885
US-20150376204-A1 ALPHA HELIX MIMETIC COMPOSITIONS FOR TREATING CANCER AND OTHER CBP/CATENIN-MEDIATED DISEASES AND CONDITIONS CREBBP, CTNNB1, CTNNA1 MTNR1A 1991/4885MTNR1B 2916/4885CNR1 2774/4885
US-20140221657-A1 ALPHA HELIX MIMETIC COMPOSITIONS FOR TREATING CANCER AND OTHER CBP/CATENIN-MEDIATED DISEASES AND CONDITIONS CREBBP, CTNNB1, CTNNA1 MTNR1A 1991/4885MTNR1B 2916/4885CNR1 2774/4885

“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.