SCHEMBL8630992

SCHEMBL8630992

Nc1ccc2c(n1)CCCC2=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.51
ALDH1A1 P00352 4/20 0.42
MAPK1 P28482 1/20 0.42
NPSR1 Q6W5P4 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
MAPT P10636 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
TP53 P04637 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
MAOA P21397 3/20 0.40
MAOB P27338 3/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
CA9 Q16790 1/20 0.40
USP2 O75604 1/20 0.39
CYP2A6 P11509 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
SCHEMBL867309 0.81 GRM5 (0.51) GRM5ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL29561825 0.81 GRM5 (0.51) GRM5ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL17361975 0.77 GRM5 (0.51) GRM5ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL23376904 0.77 GRM5 (0.51) GRM5ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL30646100 0.77 GRM5 (0.47) GRM5ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL23376905 0.77 GRM5 (0.51) GRM5ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL23376853 0.77 GRM5 (0.51) GRM5ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL3894956 0.77 CYP2C19 (0.54) GRM5ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL29526263 0.77 GRM5 (0.51) GRM5ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL18248704 0.77 GRM5 (0.48) GRM5ALDH1A1NPSR1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12583858-B2 TDO2 inhibitors GENENTECH, INC. (US) 2026-03-24 US disclosed
EP-3394068-B1 TDO2 INHIBITORS GENENTECH INC (US) 2024-09-11 EP disclosed
US-20220306635-A1 TDO2 Inhibitors GENENTECH, INC. 2022-09-29 US disclosed
CN-115010712-A TDO2 inhibitors 基因泰克公司 2022-09-06 CN disclosed
CN-110072864-B TDO2 inhibitors 基因泰克公司 2022-05-27 CN disclosed
US-10800780-B2 TDO2 Inhibitors GENENTECH, INC. (US) 2020-10-13 US disclosed
US-20190016726-A1 TDO2 Inhibitors PHARMARON BEIJING CO. LTD. (CN) 2019-01-17 US disclosed
EP-0489379-B1 5-amino-5,6,7,8-tetrahydroquinolines and related compounds, a process for their preparation and their use as medicaments HOECHST MARION ROUSSEL INC (US) 1998-07-15 EP disclosed
US-5310914-A Imination, reduction HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1994-05-10 US disclosed
US-5216164-A Used for relieving memory dysfunction such as Alzheimer's disease HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-06-01 US disclosed
EP-0489379-A1 5-amino-5,6,7,8-tetrahydroquinolines and related compounds, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-06-10 EP disclosed
US-5110815-A Alzheimer's disease HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1992-05-05 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-12583858-B2 TDO2 inhibitors TDO2, IDO2, TPH2 GRM5 3952/4885ALDH1A1 1758/4885MAPK1 3732/4885
US-20190016726-A1 TDO2 Inhibitors TDO2, IDO2, IDO1 GRM5 2128/4885ALDH1A1 2096/4885MAPK1 3297/4885
US-20220306635-A1 TDO2 Inhibitors TDO2, IDO2, IDO1 GRM5 2413/4885ALDH1A1 1849/4885MAPK1 3486/4885
US-10800780-B2 TDO2 Inhibitors TDO2, IDO2, IDO1 GRM5 2128/4885ALDH1A1 2096/4885MAPK1 3297/4885

“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.