SCHEMBL6829802

SCHEMBL6829802

COc1ccc(CSc2cncc(Br)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.51
MAOB P27338 3/20 0.49
DAO P14920 2/20 0.49
MAOA P21397 2/20 0.48
CYP1A2 P05177 1/20 0.45
CYP2E1 P05181 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C8 P10632 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2B6 P20813 1/20 0.45
CYP2C19 P33261 1/20 0.45
LMNA P02545 1/20 0.42
MMP13 P45452 1/20 0.42
TSHR P16473 1/20 0.42
CKS1B P61024 1/20 0.41
SKP2 Q13309 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL30991743 0.82 APP (0.51) APPMAOBDAOMAOALMNA
SCHEMBL25260084 0.82 APP (0.51) APPMAOBDAOMAOALMNA
SCHEMBL14125786 0.80 SMN1; SMN2 (0.43) MAOBDAOMAOACYP3A4NPC1
SCHEMBL25213547 0.80 APP (0.58) APPMAOBDAOMAOACYP3A4
SCHEMBL25245698 0.79 MAOB (0.66) APPMAOBDAOMAOATSHR
SCHEMBL25244489 0.78 DAO (0.51) APPMAOBDAOMAOACYP1A2
SCHEMBL10661250 0.78 FFAR1 (0.56) APPMAOBDAOMAOACYP1A2
SCHEMBL30991720 0.78 DAO (0.51) APPMAOBDAOMAOACYP1A2
SCHEMBL10658131 0.77 DAO (0.50) APPMAOBDAOMAOACYP1A2
SCHEMBL11883440 0.76 APP (0.54) APPMAOBDAOMAOACYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025021182-A1 CYP11A1 INHIBITORS ACERAND THERAPEUTICS (HONG KONG) LIMITED (CN) 2025-01-30 WO disclosed
CN-108137555-B Indolin-2-one derivatives useful in the treatment of CNS disorders 豪夫迈·罗氏有限公司 2021-02-19 CN disclosed
US-10377746-B2 Indolin-2-one derivatives HOFFMANN-LA ROCHE INC. (US) 2019-08-13 US disclosed
US-10377746-B2 Indolin-2-one derivatives HOFFMANN-LA ROCHE INC. (US) 2019-08-13 US disclosed
EP-3371170-B1 INDOLIN-2-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CNS DISEASES HOFFMANN LA ROCHE (CH) 2019-07-31 EP disclosed
EP-3371170-B1 INDOLIN-2-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CNS DISEASES HOFFMANN LA ROCHE (CH) 2019-07-31 EP disclosed
EP-3371170-A1 INDOLIN-2-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CNS DISEASES H. Hoffnabb-La Roche Ag (CH) 2018-09-12 EP disclosed
US-20180251455-A1 INDOLIN-2-ONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2018-09-06 US disclosed
WO-2017076932-A1 INDOLIN-2-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CNS DISEASES F. HOFFMANN-LA ROCHE AG (CH) 2017-05-11 WO disclosed
WO-2017076932-A1 INDOLIN-2-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CNS DISEASES F. HOFFMANN-LA ROCHE AG (CH) 2017-05-11 WO disclosed
US-6831175-B2 Such as N,N-dimethyl-N-(2-((5-((E)-2-pyridin-4-ylvinyl) pyridin-3-yl)oxy)ethyl)amine ABBOTT LABORATORIES 2004-12-14 US disclosed
EP-1463505-A2 3-(PHENYL-ALKOXY)-5-(PHENYL)-PYRIDINE DERIVATIVES AND RELATED COMPOUNDS AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER Abbott Laboratories (US) 2004-10-06 EP disclosed
US-20030199511-A1 Kinase inhibitors ABBVIE INC. 2003-10-23 US disclosed
US-20030187026-A1 Kinase inhibitors ABBOTT LABORATORIES 2003-10-02 US disclosed
WO-2003051366-A2 3-(PHENYL-ALKOXY)-5-(PHENYL)-PYRIDINE DERIVATIVES AND RELATED COMPOUNDS AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER ABBOTT LABORATORIES (US) 2003-06-26 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 (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-20030187026-A1 Kinase inhibitors MAP3K20, MAP3K19, MAP3K1 APP 4630/4885MAOB 2855/4885DAO 2903/4885
US-20180251455-A1 INDOLIN-2-ONE DERIVATIVES HTR3C, GRIN2D, DRD2 APP 553/4885MAOB 219/4885DAO 2973/4885
US-10377746-B2 Indolin-2-one derivatives HTR3C, GRIN2D, DRD2 APP 553/4885MAOB 219/4885DAO 2973/4885
US-20030199511-A1 Kinase inhibitors MAP3K20, MAP3K19, MAP3K1 APP 4630/4885MAOB 2855/4885DAO 2903/4885

“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.