SCHEMBL3978504

SCHEMBL3978504

Cc1nc2ccccc2n(C)c1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.62
ALDH1A1 P00352 7/20 0.62
SMN1; SMN2 Q16637 4/20 0.62
HPGD P15428 3/20 0.62
GAA P10253 2/20 0.62
GLA P06280 1/20 0.58
MAPT P10636 5/20 0.55
RAB9A P51151 3/20 0.55
NPC1 O15118 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
LMNA P02545 1/20 0.55
POLB P06746 1/20 0.55
MAPK1 P28482 1/20 0.55
HTT P42858 2/20 0.53
HDAC6 Q9UBN7 1/20 0.53
PKM P14618 1/20 0.53
ATM Q13315 1/20 0.52
FGFR1 P11362 1/20 0.51
THRB P10828 1/20 0.51

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
SCHEMBL30868870 1.00 KDM4E (0.62) KDM4EALDH1A1SMN1; SMN2HPGDGAA
Hydrochloric Acid SCHEMBL31039939 0.98 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2HPGDGAA
Hydrochloric Acid SCHEMBL31039933 0.98 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2HPGDGAA
SCHEMBL28091224 0.79 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2HPGDGAA
SCHEMBL4176723 0.79 KDM4E (0.50) KDM4EALDH1A1SMN1; SMN2HPGDGAA
SCHEMBL29559517 0.79 SMN1; SMN2 (0.63) KDM4EALDH1A1SMN1; SMN2HPGDGAA
SCHEMBL29466906 0.79 KDM4E (0.60) KDM4EALDH1A1SMN1; SMN2HPGDGAA
SCHEMBL5550211 0.79 SMN1; SMN2 (0.63) KDM4EALDH1A1SMN1; SMN2HPGDGAA
SCHEMBL30139977 0.78 KDM4E (0.82) KDM4EALDH1A1SMN1; SMN2HPGDGAA
SCHEMBL28516529 0.78 KDM4E (0.82) KDM4EALDH1A1SMN1; SMN2HPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104892573-A 3-vinyl-quinoxaline-2(1H)-one derivatives acting on FGFR-1, preparation method and uses thereof UNIV WENZHOU MEDICAL 2015-09-09 CN claimed
EP-1272479-A2 NOVEL COMPOUNDS FOR ENHANCING CHEMOTHERAPY THE PENN STATE RESEARCH FOUNDATION (US) 2003-01-08 EP claimed
US-20020013322-A1 Novel compounds for enhancing chemotherapy NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2002-01-31 US claimed
WO-2001074790-A2 NOVEL COMPOUNDS FOR ENHANCING CHEMOTHERAPY THE PENN STATE RESEARCH FOUNDATION (US) 2001-10-11 WO claimed
EP-0318294-B1 Dimeric and trimeric cationic dyes NIPPON CHEMICAL WORKS (JP) 1994-12-28 EP claimed
US-4181724-A Quinoxalinone compounds useful for expanding the lumina or air passages in mammals THE UPJOHN COMPANY (US) 1980-01-01 US claimed
CN-117924194-A 7-Thiocyanoquinoxalinone compound and synthesis method thereof 延安大学 2024-04-26 CN disclosed
CN-114907277-A Process for asymmetric hydrogenation of quinoxalinones 哈尔滨工业大学(深圳) 2022-08-16 CN disclosed
CN-111892545-B Green synthesis method of 1-methyl-3-alkyl quinoxalinone compound 怀化学院 2021-11-05 CN disclosed
CN-111892545-A Green synthesis method of 1-methyl-3-alkyl quinoxalinone compound 怀化学院 2020-11-06 CN disclosed
CN-109988117-B Preparation method of 3-methylquinoxaline-2 (1H) -ketone derivatives 湖南科技学院 2020-09-29 CN disclosed
CN-108210385-B A jelly-like collutory with effects of preventing dental caries, resisting bacteria, strengthening root and consolidating teeth 山东大学 2020-08-18 CN disclosed
CN-108078822-B Special white and black toothpaste 山东大学 2020-06-26 CN disclosed
US-20020013322-A1 Novel compounds for enhancing chemotherapy NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2002-01-31 US disclosed
WO-2001074790-A2 NOVEL COMPOUNDS FOR ENHANCING CHEMOTHERAPY THE PENN STATE RESEARCH FOUNDATION (US) 2001-10-11 WO disclosed
US-4499270-A INHIBITING THE GROWTH OF MICROORGANISMS RIKER LABORATORIES, INC. (US) 1985-02-12 US disclosed
US-4348521-A BACTERICIDES, FUNGICIDES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1982-09-07 US disclosed
US-4262123-A BRONCHODILATORS, ASTHMA, ECZEMA, URTICARIA THE UPJOHN COMPANY (US) 1981-04-14 US disclosed
US-4242342-A Quinoxalinones useful for treating atopic eczema and urticaria THE UPJOHN COMPANY (US) 1980-12-30 US disclosed
US-4181724-A Quinoxalinone compounds useful for expanding the lumina or air passages in mammals THE UPJOHN COMPANY (US) 1980-01-01 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 (1 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-20020013322-A1 Novel compounds for enhancing chemotherapy ABCB1, ABCB11, ABCC1 KDM4E 4040/4885ALDH1A1 2236/4885SMN1; SMN2 4549/4885

“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.