SCHEMBL315321

SCHEMBL315321

[CH2]n1ncc2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.47
CYP1A2 P05177 1/20 0.43
KMO O15229 1/20 0.42
ADRA2A P08913 2/20 0.39
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39
HSD17B10 Q99714 3/20 0.37
SLC22A12 Q96S37 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
CASP1 P29466 1/20 0.37
RAB9A P51151 1/20 0.37
CASP7 P55210 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL276288 0.73 RECQL (0.48) RECQLCYP1A2KMOADRA2AADRA2B
SCHEMBL47226 0.71 CYP1A2 (0.47) RECQLCYP1A2KMOADRA2AADRA2B
SCHEMBL18877 0.71 RECQL (0.47) RECQLCYP1A2KMOADRA2AADRA2B
SCHEMBL3535213 0.71 RECQL (0.52) RECQLCYP1A2KMOADRA2AADRA2B
SCHEMBL61456 0.71 RECQL (0.47) RECQLCYP1A2KMOADRA2AADRA2B
SCHEMBL13647386 0.71 RECQL (0.47) RECQLCYP1A2KMOADRA2AADRA2B
SCHEMBL329140 0.71 RECQL (0.47) RECQLCYP1A2KMOADRA2AADRA2B
SCHEMBL787026 0.71 RECQL (0.47) RECQLCYP1A2KMOADRA2AADRA2B
SCHEMBL2010731 0.71 RECQL (0.47) RECQLCYP1A2KMOADRA2AADRA2B
Water SCHEMBL2123597 0.71 CYP1A2 (0.47) RECQLCYP1A2KMOADRA2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11999740-B2 Fused pyrazine derivatives as A2A / A2B inhibitors INCYTE CORPORATION (US) 2024-06-04 US claimed
US-20220135570-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS INCYTE CORPORATION 2022-05-05 US claimed
CN-113166153-A Fused pyrazine derivatives as A2A/A2B inhibitors 因赛特公司 2021-07-23 CN claimed
EP-3818063-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS Incyte Corporation (US) 2021-05-12 EP claimed
US-20200031835-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS INCYTE CORPORATION 2020-01-30 US claimed
US-8680290-B2 Isoxazoline derivatives and their use as herbicides SYNGENTA LIMITED (GB) 2014-03-25 US claimed
CN-102143940-A Cyclohexyl amide derivatives as CRF-1 receptor antagonists and uses thereof NOVARTIS AG 2011-08-03 CN claimed
CN-101052628-B Isoxazoline derivatives and herbicidal use thereof SYNGENTA LTD 2011-07-27 CN claimed
CN-102112449-A Phenyl or pyridinyl substituted indazoles derivatives ASTRAZENECA AB 2011-06-29 CN claimed
EP-1789401-B1 ISOXAZOLINE DERIVATIVES AND THEIR USE AS HERBICIDES SYNGENTA LTD (GB) 2010-03-03 EP claimed
EP-2091929-A1 AGENTS THAT DISRUPT CELLULAR REPLICATION AND THEIR USE IN INHIBITING PATHOLOGICAL CONDITIONS The European Molecular Biology Laboratory (DE) 2009-08-26 EP claimed
WO-2007107352-A1 AGENTS THAT DISRUPT CELLULAR REPLICATION AND THEIR USE IN INHIBITING PATHOLOGICAL CONDITIONS THE EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 2007-09-27 WO claimed
WO-2007001335-A2 RAMOPLANIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-01-04 WO claimed
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. (US) 2006-09-21 US claimed
CN-1192209-A Method for preparing N-monosubstituted and N,N'-disubstituted unsymmetrical cyclic ureas DU PONT MERCK PHARMA (US) 1998-09-02 CN claimed
CN-88102628-A Novel substituted silylalkyleneamines 1988-11-30 CN claimed
US-11999740-B2 Fused pyrazine derivatives as A2A / A2B inhibitors INCYTE CORPORATION (US) 2024-06-04 US disclosed
CN-117715893-A Combination therapy comprising a MAT2A inhibitor and a PRMT type II inhibitor 伊迪亚生物科学公司 2024-03-15 CN disclosed
CN-86103278-A The method for preparing heterocyclic amide derivative 1986-12-17 CN disclosed
CN-85108623-A Preparation has the novel method of the heterocycleamide of medical active 1986-07-30 CN 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-20220135570-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS ADORA2A, ADORA2B, ADORA1 RECQL 1168/4885CYP1A2 162/4885KMO 682/4885
US-20200031835-A1 FUSED PYRAZINE DERIVATIVES AS A2A / A2B INHIBITORS ADORA2A, ADORA2B, ADORA1 RECQL 1168/4885CYP1A2 162/4885KMO 682/4885
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity CLSPN, LMAN2, RPN2 RECQL 2727/4885CYP1A2 4174/4885KMO 3833/4885
US-11999740-B2 Fused pyrazine derivatives as A2A / A2B inhibitors ADORA2A, ADORA2B, ADORA1 RECQL 1168/4885CYP1A2 162/4885KMO 682/4885

“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.