SCHEMBL19627474

SCHEMBL19627474

COC(=O)[C@]1(COCc2ccccc2)CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL15924523 1.00
SCHEMBL19627470 1.00
SCHEMBL11953973 0.93 TACR1 (0.45)
SCHEMBL18568276 0.91
SCHEMBL19614478 0.90 TACR1 (0.45)
SCHEMBL19614476 0.90 TACR1 (0.45)
SCHEMBL703326 0.90 TACR1 (0.45)
SCHEMBL17352380 0.89
SCHEMBL704426 0.88 TACR1 (0.44)
SCHEMBL441843 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109415372-B Spiro-lactam NMDA receptor modulators and uses thereof 阿普廷伊克斯股份有限公司 2021-01-15 CN disclosed
EP-3458458-B1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF APTINYX INC (US) 2020-11-04 EP disclosed
US-10196401-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2019-02-05 US disclosed
US-10195179-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2019-02-05 US disclosed
US-20180093994-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2018-04-05 US disclosed
US-20180093994-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2018-04-05 US disclosed
US-20180092879-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2018-04-05 US disclosed
US-20180092879-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2018-04-05 US disclosed
US-9932347-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2018-04-03 US disclosed
US-9932347-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2018-04-03 US disclosed
US-9925169-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2018-03-27 US disclosed
US-9925169-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2018-03-27 US disclosed
US-20170333395-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2017-11-23 US disclosed
WO-2017201283-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF APTINYX INC. (US) 2017-11-23 WO disclosed
US-20170334922-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2017-11-23 US disclosed
US-20170334922-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2017-11-23 US disclosed
US-20170333395-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2017-11-23 US disclosed
WO-2017201285-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF APTINYX INC. (US) 2017-11-23 WO disclosed