SCHEMBL6608536

SCHEMBL6608536

O=C1OCc2cnccc21

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.55
MAOB P27338 2/20 0.55
PRF1 P14222 2/20 0.49
MAPT P10636 2/20 0.47
LMNA P02545 2/20 0.47
GAA P10253 1/20 0.47
ROCK2 O75116 7/20 0.45
AAK1 Q2M2I8 4/20 0.44
ALOX5 P09917 1/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
TYMS P04818 1/20 0.43
CYP1A2 P05177 1/20 0.43
HPGD P15428 1/20 0.43
CYP2C19 P33261 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RECQL P46063 1/20 0.42
ROCK1 Q13464 2/20 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
SCHEMBL6605649 0.84 MAOA (0.55) MAOAMAOBPRF1MAPTLMNA
SCHEMBL15466341 0.81 MAOA (0.41) MAOAMAOBPRF1MAPTLMNA
Isoquinoline SCHEMBL252739 0.78 MAOB (0.62) MAOAMAOBPRF1MAPTLMNA
SCHEMBL6615574 0.76 ROCK2 (0.54) ROCK2AAK1ROCK1
SCHEMBL4787433 0.74 CYP1A2 (0.41) MAOAMAOBROCK2AAK1CYP1A2
Hydrochloric Acid SCHEMBL28271208 0.72 MAOA (0.91) MAOAMAOBPRF1MAPTLMNA
Hydrochloric Acid SCHEMBL28935107 0.72 MAOA (0.91) MAOAMAOBPRF1MAPTLMNA
SCHEMBL6903786 0.72 MAOA (1.00) MAOAMAOBPRF1MAPTLMNA
SCHEMBL6353583 0.72 MAOA (1.00) MAOAMAOBPRF1MAPTLMNA
SCHEMBL22284 0.72 MAOA (1.00) MAOAMAOBPRF1MAPTLMNA

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0140833-B1 5- AND 6-AZAPHTHALIDES, THEIR MIXTURE OF ISOMERS, PROCESS FOR THEIR PRODUCTION AND THEIR USE IN RECORDING MATERIALS WHICH ARE SENSITIVE TO PRESSURE AND HEAT CIBA-GEIGY AG (CH) 1988-03-02 EP claimed
JP-7278452-A None JP disclosed
US-10759795-B2 Aza-A-ring indenoisoquinoline topoisomerase I poisons PURDUE RESEARCH FOUNDATION (US) 2020-09-01 US disclosed
US-10759795-B2 Aza-A-ring indenoisoquinoline topoisomerase I poisons PURDUE RESEARCH FOUNDATION (US) 2020-09-01 US disclosed
US-10233191-B2 Fused piperidine amides as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2019-03-19 US disclosed
US-10233191-B2 Fused piperidine amides as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2019-03-19 US disclosed
WO-2017160898-A1 AZA-A-RING INDENOISOQUINOLINE TOPOISOMERASE I POISONS PURDUE RESEARCH FOUNDATION (US) 2017-09-21 WO disclosed
WO-2017160898-A1 AZA-A-RING INDENOISOQUINOLINE TOPOISOMERASE I POISONS PURDUE RESEARCH FOUNDATION (US) 2017-09-21 WO disclosed
US-9539307-B2 Compositions and methods for treating amyotrophic lateral sclerosis THE RESEARCH INSTITUTE AT NATIONWIDE CHILDREN'S HOSPITAL (US) 2017-01-10 US disclosed
US-20160159815-A1 Fused Piperidine Amides as Modulators of Ion Channels VERTEX PHARMACEUTICALS INCORPORATED 2016-06-09 US disclosed
US-6710047-B2 INHIBIT THE ACTIVITY OF THE VEGF RECEPTOR TYROSINE KINASE AND THE GROWTH OF TUMOURS NOVARTIS AG (CH) 2004-03-23 US disclosed
US-20030191129-A1 Phthalazines with angiogenesis inhibiting activity BOLD GUIDO (CH) 2003-10-09 US disclosed
US-6514974-B2 1-(4-Chloroanilino)-4-(4-pyridylmethyl)phthalazine for example NOVARTIS AG (CH) 2003-02-04 US disclosed
US-20020091261-A1 Phthalazines with angiogenesis inhibiting activity BOLD GUIDO (CH) 2002-07-11 US disclosed
JP-H07278452-A PRODUCTION OF 5-AZAPHTHALIDE DERIVATIVE FUJI PHOTO FILM CO LTD 1995-10-24 JP disclosed
US-5369084-A Isonicotinic acid derivatives and related spiro compounds with herbicidal action JANSSEN PHARMACEUTICAL N.V. (BE) 1994-11-29 US disclosed
WO-1992009577-A1 ISONICOTINIC ACID DERIVATIVES AND RELATED SPIRO COMPOUNDS WITH HERBICIDAL ACTION JANSSEN PHARMACEUTICA N.V. (BE) 1992-06-11 WO disclosed
US-4337340-A FROM DIPHENYLAMINES AND BENZOYL OR 3-INDOLYLCARBONYL PYRIDINE- OR PYRAZINECARBOXYLIC ACIDS STERLING DRUG INC. (US) 1982-06-29 US disclosed
US-4243250-A FUROPYRIDINONES OR FUROPYRAZINONES AS COLOR FORMERS STERLING DRUG INC. (US) 1981-01-06 US disclosed
US-4211872-A COLOR FORMERS FREEDOM CHEMICAL COMPANY 1980-07-08 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 (5 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-20030191129-A1 Phthalazines with angiogenesis inhibiting activity PGF, VEGFA, FLT4 MAOA 694/4885MAOB 464/4885PRF1 3729/4885
US-10759795-B2 Aza-A-ring indenoisoquinoline topoisomerase I poisons TOP1, TOP2A, TOP2B MAOA 1076/4885MAOB 1285/4885PRF1 1049/4885
US-10233191-B2 Fused piperidine amides as modulators of ion channels TRPV1, TRPA1, KCNJ2 MAOA 2734/4885MAOB 3125/4885PRF1 3143/4885
US-20160159815-A1 Fused Piperidine Amides as Modulators of Ion Channels TRPV1, TRPA1, KCNJ2 MAOA 2734/4885MAOB 3125/4885PRF1 3143/4885
US-20020091261-A1 Phthalazines with angiogenesis inhibiting activity PGF, VEGFA, FLT4 MAOA 675/4885MAOB 440/4885PRF1 3521/4885

“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.