SCHEMBL11258641

SCHEMBL11258641

C1C[C]2CCNCCC2C1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.37
SLC18A3 Q16572 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
HTR2C P28335 4/20 0.32
HTR3A P46098 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
GABRA1 P14867 2/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
PLG P00747 1/20 0.31
QDPR P09417 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
DPP7 Q9UHL4 1/20 0.31

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
SCHEMBL27840522 0.85 NISCH (0.37) HRH4SLC18A3SIGMAR1HTR2CDPP7
SCHEMBL28247554 0.85 SLC18A3 (0.39) HRH4SLC18A3SIGMAR1HTR2CHTR3A
SCHEMBL3764762 0.82
SCHEMBL7499316 0.81
SCHEMBL149012 0.79
SCHEMBL7501843 0.74 CYP2D6 (0.38) HTR2CHTR3A
SCHEMBL18763492 0.74 HRH4 (0.36) HRH4SLC18A3SIGMAR1HTR3A
SCHEMBL25391815 0.73
SCHEMBL102091 0.73
SCHEMBL102511 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-9562029-B2 C-glycoside derivatives Xuanzhu Pharma Co., Ltd. (CN) 2017-02-07 US disclosed
US-9487545-B2 Fused ring-containing oxazolidinones antibiotics Xuanzhu Pharma Co., Ltd. (CN) 2016-11-08 US disclosed
EP-2725031-B1 C-GLYCOSIDE DERIVATIVES XUANZHU PHARMA CO LTD (CN) 2016-08-03 EP disclosed
US-20140243288-A1 FUSED RING-CONTAINING OXAZOLIDINONES ANTIBIOTICS Xuanzhu Pharma Co., Ltd. (CN) 2014-08-28 US disclosed
EP-2762480-A1 OXAZOLIDINONE ANTIBIOTICS CONTAINING FUSED RING Xuanzhu Pharma Co., Ltd. (CN) 2014-08-06 EP 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
US-7816398-B2 Fatty alcohol drug conjugates LUITPOLD PHARMACEUTICALS, INC. (US) 2010-10-19 US disclosed
US-4345071-A AZIDOALKYL-HETEROCYCLIC AMIDINE INTERMEDIATES LEO PHARMACEUTICAL PRODUCTS, LTD. A/S (DK) 1982-08-17 US disclosed
US-4259333-A ANTIBIOTICS, BACTERICIDES LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 1981-03-31 US disclosed
US-4246262-A ANTIBIOTICS LEO PHARMACEUTICAL PRODUCTS, LTD. A/S (DK) 1981-01-20 US disclosed
US-4229443-A Derivatives of penicillanic acid LEO PHARMACEUTICAL PRODUCTS, LTD. A/S (DK) 1980-10-21 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-20140128331-A1 C-GLYCOSIDE DERIVATIVES RDX, C3AR1, C1R HRH4 1145/4885SLC18A3 3239/4885SIGMAR1 1843/4885
US-20140243288-A1 FUSED RING-CONTAINING OXAZOLIDINONES ANTIBIOTICS OXA1L, O60361, OXER1 HRH4 226/4885SLC18A3 4819/4885SIGMAR1 1824/4885
US-10253010-B2 C-glycoside derivative RDX, C1R, C3AR1 HRH4 1114/4885SLC18A3 3261/4885SIGMAR1 1912/4885
US-20170101388-A1 C-GLYCOSIDE DERIVATIVE RDX, C1R, C3AR1 HRH4 1114/4885SLC18A3 3261/4885SIGMAR1 1912/4885

“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.