SCHEMBL15680693

SCHEMBL15680693

c1ccc(OC2CC3CC3C2)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 7/20 0.59
SLC6A3 Q01959 6/20 0.59
SLC6A4 P31645 6/20 0.59
HRH1 P35367 2/20 0.52
GRIN1 Q05586 6/20 0.45
GRIN2B Q13224 6/20 0.45
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
NAAA Q02083 1/20 0.38
LTA4H P09960 1/20 0.38
TSHR P16473 1/20 0.38
HTR1A P08908 1/20 0.37

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
SCHEMBL24267286 0.87 SLC6A2 (0.53) SLC6A2SLC6A3SLC6A4HRH1GRIN1
SCHEMBL20086419 0.83 SLC6A4 (0.56) SLC6A2SLC6A3SLC6A4HRH1GRIN1
SCHEMBL14704876 0.83 SLC6A4 (0.56) SLC6A2SLC6A3SLC6A4HRH1GRIN1
SCHEMBL24136460 0.83 SLC6A4 (0.56) SLC6A2SLC6A3SLC6A4HRH1GRIN1
SCHEMBL17633193 0.83 SLC6A4 (0.56) SLC6A2SLC6A3SLC6A4HRH1GRIN1
SCHEMBL17633190 0.83 SLC6A4 (0.56) SLC6A2SLC6A3SLC6A4HRH1GRIN1
SCHEMBL24267396 0.82 SLC6A2 (0.49) SLC6A2SLC6A3SLC6A4HRH1GRIN1
SCHEMBL20046785 0.79 SLC6A2 (0.57) SLC6A2SLC6A3SLC6A4HRH1HTR1A
SCHEMBL30182887 0.79 SLC6A2 (0.57) SLC6A2SLC6A3SLC6A4HRH1HTR1A
SCHEMBL18610915 0.79 SLC6A2 (0.58) SLC6A2SLC6A3SLC6A4HRH1GRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118546055-A Preparation method of (1R, 3S, 5S) -3- (4- (5-bromo-2-chlorobenzyl) phenoxy) bicyclo [3.1.0] hexane 山东科巢生物制药有限公司 2024-08-27 CN disclosed
US-10253010-B2 C-glycoside derivative SIHUAN PHARMACEUTICAL HOLDINGS GROUP LTD. (CN) 2019-04-09 US disclosed
US-20170101388-A1 C-GLYCOSIDE DERIVATIVE Xuanzhu Pharma Co., Ltd. (CN) 2017-04-13 US disclosed
US-20170101388-A1 C-GLYCOSIDE DERIVATIVE Xuanzhu Pharma Co., Ltd. (CN) 2017-04-13 US disclosed
US-9562029-B2 C-glycoside derivatives Xuanzhu Pharma Co., Ltd. (CN) 2017-02-07 US disclosed
US-9562029-B2 C-glycoside derivatives Xuanzhu Pharma Co., Ltd. (CN) 2017-02-07 US disclosed
US-20140128331-A1 C-GLYCOSIDE DERIVATIVES Xuanzhu Pharma Co., Ltd. (CN) 2014-05-08 US disclosed
US-20140128331-A1 C-GLYCOSIDE DERIVATIVES Xuanzhu Pharma Co., Ltd. (CN) 2014-05-08 US disclosed
EP-2725031-A1 C-GLYCOSIDE DERIVATIVES Xuanzhu Pharma Co., Ltd. (CN) 2014-04-30 EP 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-20140128331-A1 C-GLYCOSIDE DERIVATIVES RDX, C3AR1, C1R SLC6A2 2963/4885SLC6A3 3028/4885SLC6A4 3671/4885
US-10253010-B2 C-glycoside derivative RDX, C1R, C3AR1 SLC6A2 2955/4885SLC6A3 2832/4885SLC6A4 3582/4885
US-20170101388-A1 C-GLYCOSIDE DERIVATIVE RDX, C1R, C3AR1 SLC6A2 2955/4885SLC6A3 2832/4885SLC6A4 3582/4885

“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.