SCHEMBL7932045

SCHEMBL7932045

O=C(OCc1ccccc1)N1CCCC12CNC2=O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 3/20 0.46
HTR1A P08908 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
HTR2C P28335 1/20 0.45
SLC6A3 Q01959 1/20 0.45
NPC1 O15118 1/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
OPRM1 P35372 1/20 0.43
AVPR1A P37288 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL22213479 0.89 OPRK1 (0.45) OPRK1HTR1AADORA3HTR2CSLC6A3
SCHEMBL7924755 0.87 DDB1 (0.40) DDB1CRBN
SCHEMBL12816594 0.84 OPRK1 (0.45) OPRK1HTR1AADORA3HTR2CSLC6A3
SCHEMBL12028818 0.82 NPC1 (0.46) NPC1RAB9AMEN1KMT2ANPSR1
SCHEMBL23540253 0.82 OPRK1 (0.44) OPRK1HTR1AADORA3HTR2CSLC6A3
SCHEMBL20130456 0.81 DDB1 (0.42) OPRK1HTR1AADORA3HTR2CSLC6A3
SCHEMBL12028817 0.80
SCHEMBL18541559 0.79 NAAA (0.36) OPRK1OPRM1AVPR1A
SCHEMBL15937145 0.79 CTSL (0.47) RAB9A
SCHEMBL21153687 0.79 NAAA (0.38) OPRK1HTR1AADORA3HTR2CSLC6A3

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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210332061-A1 NMDA RECEPTOR MODULATORS AND USES THEREOF NAUREX, INC. 2021-10-28 US disclosed
US-20210169964-A1 METHODS OF TREATING ALZHEIMER'S DISEASE, HUNTINGTON'S DISEASE, AUTISM, AND OTHER DISORDERS INNOVIVA TRC HOLDINGS LLC 2021-06-10 US disclosed
US-10906913-B2 NMDA receptor modulators and uses thereof NORTHWESTERN UNIVERSITY (US) 2021-02-02 US disclosed
US-10316041-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2019-06-11 US disclosed
US-20190077807-A1 NMDA RECEPTOR MODULATORS AND USES THEREOF NAUREX, INC. 2019-03-14 US disclosed
US-20180179217-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2018-06-28 US disclosed
US-20180127430-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2018-05-10 US disclosed
US-20180127430-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2018-05-10 US disclosed
US-9802946-B2 NMDA receptor modulators and uses thereof NORTHWESTERN UNIVERSITY (US) 2017-10-31 US disclosed
US-9802946-B2 NMDA receptor modulators and uses thereof NORTHWESTERN UNIVERSITY (US) 2017-10-31 US disclosed
US-20150105364-A1 NMDA Receptor Modulators and Uses Thereof NORTHWESTERN UNIVERSITY (US) 2015-04-16 US disclosed
WO-2014120786-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF NAUREX, INC. (US) 2014-08-07 WO disclosed
WO-2014120800-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF NAUREX, INC. (US) 2014-08-07 WO disclosed
WO-2014120800-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF NAUREX, INC. (US) 2014-08-07 WO disclosed
US-20130053325-A1 Secondary Structure Stabilized NMDA Receptor Modulators and Uses Thereof INNOVIVA TRC HOLDINGS LLC 2013-02-28 US disclosed
US-20130053325-A1 Secondary Structure Stabilized NMDA Receptor Modulators and Uses Thereof INNOVIVA TRC HOLDINGS LLC 2013-02-28 US disclosed
US-20110306586-A1 NMDA Receptor Modulators and Uses Thereof NAUREX, INC. 2011-12-15 US disclosed
US-20110306586-A1 NMDA Receptor Modulators and Uses Thereof NAUREX, INC. 2011-12-15 US disclosed
WO-2011100585-A1 SECONDARY STRUCTURE STABILIZED NMDA RECEPTOR MODULATORS AND USES THEREOF MOSKAL JOSEPH (US) 2011-08-18 WO disclosed
WO-2010033757-A1 NMDA RECEPTOR MODULATORS AND USES THEREOF NAUREX, INC. (US) 2010-03-25 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 (10 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-20190077807-A1 NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A OPRK1 19/4885HTR1A 248/4885ADORA3 404/4885
US-20210169964-A1 METHODS OF TREATING ALZHEIMER'S DISEASE, HUNTINGTON'S DISEASE, AUTISM, AND OTHER DISORDERS GRIN2A, GRIN3A, GRIN1 OPRK1 431/4885HTR1A 44/4885ADORA3 182/4885
US-10316041-B2 Spiro-lactam NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN3A OPRK1 30/4885HTR1A 127/4885ADORA3 799/4885
US-20130053325-A1 Secondary Structure Stabilized NMDA Receptor Modulators and Uses Thereof GRIN2A, GRIN1, GRIN3A OPRK1 21/4885HTR1A 297/4885ADORA3 593/4885
US-20150105364-A1 NMDA Receptor Modulators and Uses Thereof GRIN1, GRIN2A, GRIN3A OPRK1 19/4885HTR1A 248/4885ADORA3 404/4885
US-20180127430-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A OPRK1 30/4885HTR1A 127/4885ADORA3 799/4885
US-20180179217-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A OPRK1 30/4885HTR1A 127/4885ADORA3 799/4885
US-20210332061-A1 NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A OPRK1 19/4885HTR1A 248/4885ADORA3 404/4885
US-20110306586-A1 NMDA Receptor Modulators and Uses Thereof GRIN1, GRIN2A, GRIN3A OPRK1 19/4885HTR1A 248/4885ADORA3 404/4885
US-10906913-B2 NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN3A OPRK1 19/4885HTR1A 248/4885ADORA3 404/4885

“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.