SCHEMBL19853733

SCHEMBL19853733

NC(=O)CN1CC2(CCC(OCc3ccccc3)CC2)C1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.47
OPRM1 P35372 5/20 0.44
OPRL1 P41146 5/20 0.44
SIGMAR1 Q99720 2/20 0.43
RIPK1 Q13546 1/20 0.43
BCHE P06276 2/20 0.39
EPHX2 P34913 1/20 0.39
CTSL P07711 2/20 0.39
CTSB P07858 2/20 0.39
CTSK P43235 2/20 0.39
CTSV O60911 1/20 0.39
CTSS P25774 1/20 0.39
CTSC P53634 1/20 0.39
CTSF Q9UBX1 1/20 0.39
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38

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
SCHEMBL19853693 0.83 RIPK1 (0.48) OPRM1OPRL1RIPK1CYP2C19SMN1; SMN2
SCHEMBL19853770 0.77 DPP4 (0.44) DPP4OPRM1OPRL1SIGMAR1BCHE
SCHEMBL19853717 0.77 DPP4 (0.44) DPP4OPRM1OPRL1SIGMAR1BCHE
SCHEMBL19853694 0.77 DPP4 (0.41) DPP4OPRM1OPRL1SIGMAR1BCHE
SCHEMBL19853720 0.77 DPP4 (0.41) DPP4OPRM1OPRL1SIGMAR1BCHE
SCHEMBL19853721 0.77 DPP4 (0.43) DPP4OPRM1OPRL1SIGMAR1BCHE
SCHEMBL19853696 0.77 DPP4 (0.43) DPP4OPRM1OPRL1SIGMAR1BCHE
SCHEMBL19839342 0.76 RIPK1 (0.46) OPRM1OPRL1SIGMAR1RIPK1
SCHEMBL21034523 0.76 OPRM1 (0.42) DPP4OPRM1OPRL1SIGMAR1BCHE
SCHEMBL19853726 0.76 OPRM1 (0.42) DPP4OPRM1OPRL1SIGMAR1BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220273629-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH ELEVATED LEVELS OF ANTIBODIES THAT INTERACT WITH THE NMDA RECEPTOR TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2022-09-01 US disclosed
US-20220002242-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2022-01-06 US disclosed
US-10961189-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2021-03-30 US disclosed
WO-2021021996-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH ELEVATED LEVELS OF ANTIBODIES THAT INTERACT WITH THE NMDA RECEPTOR APTINYX INC. (US) 2021-02-04 WO disclosed
US-20190161442-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2019-05-30 US disclosed
WO-2018026763-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF APTINYX INC. (US) 2018-02-08 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 (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-20190161442-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A DPP4 2195/4885OPRM1 35/4885OPRL1 27/4885
US-10961189-B2 Spiro-lactam NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN3A DPP4 2195/4885OPRM1 35/4885OPRL1 27/4885
US-20220273629-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH ELEVATED LEVELS OF ANTIBODIES THAT INTERACT WITH THE NMDA RECEPTOR GRIN2A, GRIN2B, GRIN1 DPP4 3041/4885OPRM1 353/4885OPRL1 55/4885
US-20220002242-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A DPP4 2195/4885OPRM1 35/4885OPRL1 27/4885

“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.