SCHEMBL4319982

SCHEMBL4319982

N#CCn1ncc2ccccc21

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.70
RECQL P46063 2/20 0.56
KMO O15229 1/20 0.50
ADRA2A P08913 1/20 0.44
DAO P14920 1/20 0.42
ALDH1A1 P00352 1/20 0.41
POLB P06746 3/20 0.40
P2RX7 Q99572 1/20 0.40
TSHR P16473 4/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
HSD17B10 Q99714 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
GLA P06280 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
SCHEMBL31236306 1.00 CYP1A2 (0.70) CYP1A2RECQLKMOADRA2ADAO
SCHEMBL4287336 0.81 RECQL (0.56) CYP1A2RECQLKMOADRA2ADAO
SCHEMBL30755148 0.81 RECQL (0.56) CYP1A2RECQLKMOADRA2ADAO
SCHEMBL14612118 0.80 CYP1A2 (0.82) CYP1A2RECQLKMOADRA2ADAO
SCHEMBL31429402 0.79 RECQL (0.53) CYP1A2RECQLKMOADRA2ADAO
SCHEMBL27244212 0.77 CYP1A2 (0.51) CYP1A2RECQLKMO
SCHEMBL7331551 0.76 RECQL (0.69) CYP1A2RECQLKMOADRA2ADAO
SCHEMBL6783242 0.76 CYP1A2 (0.43) CYP1A2KMOADRA2A
SCHEMBL13607554 0.76 KMO (0.55) CYP1A2KMOADRA2APOLBTSHR
SCHEMBL30861000 0.76 CYP1A2 (0.43) CYP1A2KMOADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230339916-A1 PLANT GROWTH REGULATOR COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-10-26 US disclosed
US-20230339916-A1 PLANT GROWTH REGULATOR COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-10-26 US disclosed
CN-116332851-A Cyanomethyl phenyl indazole compound and preparation method thereof 河南中医药大学 2023-06-27 CN disclosed
EP-1871765-B1 3-(INDAZOL-5-YL)-(1,2,4)TRIAZINE DERIVATIVES AND RELATED COMPOUNDS AS PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF CANCER SCHERING CORP (US) 2009-12-09 EP disclosed
US-7528132-B2 immunodeficiencies, cancers, cardiovascular diseases, endocrine disorders, Parkinson's disease, metabolic diseases, tumorigenesis, Alzheimer's disease, heart disease, diabetes, neurodegeneration, inflammation, kidney disease, atherosclerosis and airway disease; indazolyl [1,2,4]triazine compounds SCHERING CORPORATION (US) 2009-05-05 US disclosed
US-20080004257-A1 Kinase inhibitors SCHERING CORPORATION 2008-01-03 US disclosed
EP-1871765-A2 3-(INDAZOL-5-YL)-(1,2,4)TRIAZINE DERIVATIVES AND RELATED COMPOUNDS AS PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF CANCER SCHERING CORPORATION (US) 2008-01-02 EP disclosed
WO-2006081230-A2 3-(INDAZOL-5-YL)-(1,2, 4) TRIAZINE DERIVATIVES AND RELATED COMPOUNDS AS PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF CANCER SCHERING CORPORATION (US) 2006-08-03 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 (2 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-20230339916-A1 PLANT GROWTH REGULATOR COMPOUNDS MYB, TOE1, SUB1 CYP1A2 1544/4885RECQL 4041/4885KMO 928/4885
US-20080004257-A1 Kinase inhibitors MAP3K1, MAP3K13, MAP3K6 CYP1A2 3713/4885RECQL 3773/4885KMO 388/4885

“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.