SCHEMBL2426261

SCHEMBL2426261

Cc1c(C(=O)O)ccc2[nH]nnc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRB1 P18505 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA5 P31644 1/20 0.40
GABRA3 P34903 1/20 0.40
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
GABRA4 P48169 1/20 0.40
GABRE P78334 1/20 0.40
GABRA6 Q16445 1/20 0.40
GABRG1 Q8N1C3 1/20 0.40
GABRG3 Q99928 1/20 0.40
GABRQ Q9UN88 1/20 0.40
ALDH1A1 P00352 4/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
CYP1A2 P05177 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL2876920 0.82 MAPT (0.42) SMN1; SMN2TSHRKDM4ERAB9AL3MBTL1
SCHEMBL6052102 0.81 ALDH1A1 (0.47) ALDH1A1CYP1A2KDM4EHPGDKDM6B
SCHEMBL8953072 0.81 CYP1A2 (0.35) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9171594 0.79 ALDH1A1 (0.46) ALDH1A1CYP1A2KDM4EHPGDKDM6B
SCHEMBL16759828 0.79 KDM4E (0.40) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL18528853 0.79 TSHR (0.39) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9617483 0.79 GABRP (0.40) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL13516226 0.79 TDP1 (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4755009 0.79 HAO1 (0.33) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL6033323 0.76 SMN1; SMN2 (0.32) GABRPGABRDGABRA1GABRB1GABRG2

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
EP-1462295-B1 Onament and indicator panel for vehicle interior CALSONIC KANSEI CORP (JP) 2008-01-23 EP claimed
US-20040228986-A1 Interior ornament and indicator panel for vehicle CALSONIC KANSEI CORPORATION (JP) 2004-11-18 US claimed
EP-1462295-A2 Onament and indicator panel for vehicle interior Calsonic Kansei Corporation (JP) 2004-09-29 EP claimed
US-20220162192-A1 INDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. 2022-05-26 US disclosed
US-20220162192-A1 INDAZOLES AS LRRK2 INHIBITORS ESCAPE Bio, Inc. 2022-05-26 US disclosed
WO-2021032323-A1 FUSED PYRIMIDINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROTIC DISEASES GALAPAGOS NV (BE) 2021-02-25 WO disclosed
EP-3782997-A1 FUSED PYRIMIDINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROTIC DISEASES Galapagos N.V. (BE) 2021-02-24 EP disclosed
EP-3782997-A1 FUSED PYRIMIDINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROTIC DISEASES Galapagos N.V. (BE) 2021-02-24 EP disclosed
US-20200339570-A1 BICYCLIC DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2020-10-29 US disclosed
WO-2020191261-A1 INDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. (US) 2020-09-24 WO disclosed
WO-2020191261-A1 INDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. (US) 2020-09-24 WO disclosed
EP-2900669-B1 HEXAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AND RELATED COMPOUNDS AS AUTOTAXIN (ATX) INHIBITORS AND AS INHIBITORS OF THE LYSOPHOSPHATIDIC ACID (LPA) PRODUCTION FOR TREATING E.G. RENAL DISEASES HOFFMANN LA ROCHE (CH) 2019-09-04 EP disclosed
US-8012956-B2 Tropane compounds EXELIXIS, INC. (US) 2011-09-06 US disclosed
EP-2074120-B1 TROPANE COMPOUNDS EXELIXIS INC (US) 2010-03-03 EP disclosed
EP-2074120-A1 TROPANE COMPOUNDS Exelixis, Inc. (US) 2009-07-01 EP disclosed
US-20090163471-A1 Tropane compounds EXELIXIS, INC. 2009-06-25 US disclosed
WO-2009055077-A1 TROPANE COMPOUNDS EXELIXIS, INC. (US) 2009-04-30 WO disclosed
EP-1462295-B1 Onament and indicator panel for vehicle interior CALSONIC KANSEI CORP (JP) 2008-01-23 EP disclosed
US-20040228986-A1 Interior ornament and indicator panel for vehicle CALSONIC KANSEI CORPORATION (JP) 2004-11-18 US disclosed
EP-1462295-A2 Onament and indicator panel for vehicle interior Calsonic Kansei Corporation (JP) 2004-09-29 EP 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 (3 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-20200339570-A1 BICYCLIC DERIVATIVES CCNY, BICRA, UQCRB GABRP 1284/4885GABRD 2567/4885GABRA1 1400/4885
US-20090163471-A1 Tropane compounds ADRA1B, ADRA2B, ADRB2 GABRP 1524/4885GABRD 1164/4885GABRA1 381/4885
US-20220162192-A1 INDAZOLES AS LRRK2 INHIBITORS LRRK2, PARK7, PINK1 GABRP 2924/4885GABRD 4020/4885GABRA1 2387/4885

“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.