SCHEMBL16460945

SCHEMBL16460945

NCC(c1ccc(Cl)cc1)N1CCC(F)(F)CC1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 9/20 0.51
RPS6KB1 P23443 5/20 0.45
AKT1S1 Q96B36 3/20 0.44
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
OPRL1 P41146 1/20 0.41

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
SCHEMBL16460909 0.86 P2RX7 (0.48) P2RX7RPS6KB1AKT1S1OPRM1OPRD1
SCHEMBL12278785 0.84 OPRL1 (0.48) P2RX7RPS6KB1OPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL2405292 0.83 OPRL1 (0.47) P2RX7RPS6KB1OPRM1OPRD1OPRK1
SCHEMBL16460365 0.82 P2RX7 (0.51) P2RX7RPS6KB1OPRM1OPRD1OPRK1
SCHEMBL15129216 0.82 RPS6KB1 (0.52) P2RX7RPS6KB1AKT1S1
SCHEMBL16461381 0.82 RPS6KB1 (0.50) P2RX7RPS6KB1AKT1S1OPRM1
SCHEMBL16461973 0.82 RPS6KB1 (0.50) P2RX7RPS6KB1AKT1S1
SCHEMBL16395501 0.81 RPS6KB1 (0.52) P2RX7RPS6KB1
SCHEMBL16395576 0.81 RPS6KB1 (0.52) P2RX7RPS6KB1
SCHEMBL12701169 0.81 RPS6KB1 (0.52) P2RX7RPS6KB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230149382-A1 TETRAHYDROQUINOLINE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS ASAHI KASEI PHARMA CORPORATION (JP) 2023-05-18 US disclosed
US-20230149382-A1 TETRAHYDROQUINOLINE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS ASAHI KASEI PHARMA CORPORATION (JP) 2023-05-18 US disclosed
US-11077100-B2 Tetrahydroquinoline derivatives as P2X7 receptor antagonists RAQUALIA PHARMA INC. (JP) 2021-08-03 US disclosed
US-20210085667-A1 TETRAHYDROQUINOLINE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2021-03-25 US disclosed
US-20200405706-A1 TETRAHYDROQUINOLINE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2020-12-31 US disclosed
US-20190307766-A1 CYCLIC AMINES MINDIMMUNE THERAPEUTICS, INC. 2019-10-10 US disclosed
EP-3536689-A1 2-(CYCLIC AMINEETHYL)BENZAMIDE DERIVATIVES AS P2X7 INHIBITORS MindImmune Therapeutics, Inc. (US) 2019-09-11 EP disclosed
EP-2906549-B1 N-(2-(CYCLIC AMINE)ETHYL)BENZAMIDE DERIVATIVES AS P2X7 INHIBITORS MINDIMMUNE THERAPEUTICS INC (US) 2019-04-17 EP disclosed
US-10124010-B2 Cyclic amines MINDIMMUNE THERAPEUTICS, INC. (US) 2018-11-13 US disclosed
US-20180177793-A1 CYCLIC AMINES MINDIMMUNE THERAPEUTICS, INC. 2018-06-28 US disclosed
US-9861639-B2 Cyclic amines H. LUNDBECK A/S (DK) 2018-01-09 US disclosed
US-20170128460-A1 Cyclic Amines H. LUNDBECK A/S (DK) 2017-05-11 US disclosed
US-9593105-B2 Cyclic amines H. LUNDBECK A/S (DK) 2017-03-14 US disclosed
US-20170008898-A1 Cyclic Amines H. LUNDBECK A/S (DK) 2017-01-12 US disclosed
US-9415055-B2 Cyclic amines H. LUNDBECK A/S (DK) 2016-08-16 US disclosed
US-20150306114-A1 Cyclic Amines MINDIMMUNE THERAPEUTICS, INC. 2015-10-29 US disclosed
EP-2906549-A2 CYCLIC AMINES H. Lundbeck A/S (DK) 2015-08-19 EP disclosed
US-9108938-B2 Cyclic amines H. LUNDBECK A/S (DK) 2015-08-18 US disclosed
US-20140107335-A1 Cyclic Amines H. LUNDBECK A/S (DK) 2014-04-17 US disclosed
WO-2014057080-A2 CYCLIC AMINES H. LUNDBECK A/S (DK) 2014-04-17 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 (11 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-20200405706-A1 TETRAHYDROQUINOLINE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS P2RX7, P2RX3, P2RX1 P2RX7 1/4885RPS6KB1 1965/4885AKT1S1 1737/4885
US-11077100-B2 Tetrahydroquinoline derivatives as P2X7 receptor antagonists P2RX7, P2RX3, P2RX1 P2RX7 1/4885RPS6KB1 1965/4885AKT1S1 1737/4885
US-20170008898-A1 Cyclic Amines P2RX7, ADORA2A, P2RX2 P2RX7 1/4885RPS6KB1 2290/4885AKT1S1 2617/4885
US-20150306114-A1 Cyclic Amines P2RX7, ADORA2A, P2RX2 P2RX7 1/4885RPS6KB1 2290/4885AKT1S1 2617/4885
US-20230149382-A1 TETRAHYDROQUINOLINE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS P2RX7, P2RX3, P2RX1 P2RX7 1/4885RPS6KB1 1965/4885AKT1S1 1737/4885
US-20190307766-A1 CYCLIC AMINES P2RX7, ADORA2A, P2RX2 P2RX7 1/4885RPS6KB1 2290/4885AKT1S1 2617/4885
US-20140107335-A1 Cyclic Amines P2RX7, ADORA2A, P2RX2 P2RX7 1/4885RPS6KB1 2290/4885AKT1S1 2617/4885
US-20210085667-A1 TETRAHYDROQUINOLINE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS P2RX7, P2RX3, P2RX1 P2RX7 1/4885RPS6KB1 1965/4885AKT1S1 1737/4885
US-10124010-B2 Cyclic amines P2RX7, ADORA2A, P2RX2 P2RX7 1/4885RPS6KB1 2290/4885AKT1S1 2617/4885
US-20180177793-A1 CYCLIC AMINES P2RX7, ADORA2A, P2RX2 P2RX7 1/4885RPS6KB1 2290/4885AKT1S1 2617/4885
US-20170128460-A1 Cyclic Amines P2RX7, ADORA2A, P2RX2 P2RX7 1/4885RPS6KB1 2290/4885AKT1S1 2617/4885

“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.