SCHEMBL798790

SCHEMBL798790

CC(C)c1ccc2nc(C(C)C)[nH]c2c1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 3/20 0.69
KDM4E B2RXH2 2/20 0.59
LMNA P02545 1/20 0.59
HSD17B10 Q99714 1/20 0.59
CYP1A2 P05177 1/20 0.51
MLKL Q8NB16 2/20 0.51
ALDH1A1 P00352 2/20 0.49
ALOX15 P16050 1/20 0.49
HTT P42858 2/20 0.49
USP2 O75604 1/20 0.49
HPGD P15428 1/20 0.49
ALPL P05186 1/20 0.45
ALPI P09923 1/20 0.45
ALPG P10696 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KIF11 P52732 1/20 0.43
EIF4A3 P38919 1/20 0.42
AAK1 Q2M2I8 1/20 0.42

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
SCHEMBL24998835 0.88 SCN10A (0.56) SCN10AKDM4ELMNAHSD17B10CYP1A2
SCHEMBL2706618 0.86 KDM4E (0.57) SCN10AKDM4ELMNAHSD17B10CYP1A2
SCHEMBL889358 0.85 HSD17B10 (0.59) SCN10AKDM4ELMNAHSD17B10CYP1A2
SCHEMBL23815820 0.85 SCN10A (0.71) SCN10AKDM4ELMNAHSD17B10CYP1A2
SCHEMBL25698163 0.82 SCN10A (0.56) SCN10AKDM4ELMNAHSD17B10CYP1A2
SCHEMBL23815615 0.82 SCN10A (0.58) SCN10AKDM4ELMNAHSD17B10CYP1A2
SCHEMBL890080 0.81 CYP1A2 (0.75) SCN10AKDM4ELMNAHSD17B10CYP1A2
SCHEMBL5987543 0.81 ALDH1A1 (0.58) SCN10AKDM4EHSD17B10CYP1A2ALDH1A1
SCHEMBL17821440 0.80 SCN10A (0.55) SCN10AKDM4ELMNAHSD17B10CYP1A2
SCHEMBL21335366 0.80 KDM4E (0.57) SCN10AKDM4ELMNAHSD17B10CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230285378-A1 Anti-Viral Compounds ABBVIE INC. (US) 2023-09-14 US disclosed
US-20230285569-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF FRAGILE X Design Therapeutics, Inc. 2023-09-14 US disclosed
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-09-14 US disclosed
US-20230285378-A1 Anti-Viral Compounds ABBVIE INC. (US) 2023-09-14 US disclosed
US-20230242534-A9 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-08-03 US disclosed
US-20230242534-A9 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-08-03 US disclosed
US-20230219927-A1 AKT3 MODULATORS Georgiamune Inc. 2023-07-13 US disclosed
US-20230219927-A1 AKT3 MODULATORS Georgiamune Inc. 2023-07-13 US disclosed
US-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 US disclosed
US-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 US disclosed
US-20100310512-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2010-12-09 US disclosed
US-20100310512-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2010-12-09 US disclosed
US-20100267634-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2010-10-21 US disclosed
US-20100260715-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2010-10-14 US disclosed
US-20100168138-A1 Anti-Viral Compounds ABBOTT LABORATORIES (US) 2010-07-01 US disclosed
US-7713701-B2 DNA-binding polymers CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2010-05-11 US disclosed
US-20090264426-A1 Bicyclic aromatic substituted pyridone derivative MSD K.K. (JP) 2009-10-22 US disclosed
US-20090155202-A1 DNA-BINDING POLYMERS CALIFORNIA INSTITUTE OF TECHNOLOGY 2009-06-18 US disclosed
US-7452730-B2 DNA-binding polymers CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2008-11-18 US disclosed
US-20080269138-A1 Polyamides with tail structures CALIFORNIA INSTITUTE OF TECHNOLOGY 2008-10-30 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 (13 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-20100168138-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS SCN10A 4583/4885KDM4E 2318/4885LMNA 3118/4885
US-20100267634-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS SCN10A 4583/4885KDM4E 2318/4885LMNA 3118/4885
US-20080269138-A1 Polyamides with tail structures HNRNPH3, PCNA, DNAH12 SCN10A 3872/4885KDM4E 1338/4885LMNA 533/4885
US-20230183226-A1 AKT3 MODULATORS AKT3, AKT2, MTOR SCN10A 2866/4885KDM4E 4095/4885LMNA 1249/4885
US-20100260715-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, EIF2AK2 SCN10A 4134/4885KDM4E 1193/4885LMNA 2800/4885
US-20230285378-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS SCN10A 4583/4885KDM4E 2318/4885LMNA 3118/4885
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE NEDD4, CBL, UBQLN2 SCN10A 2390/4885KDM4E 2603/4885LMNA 2020/4885
US-20230219927-A1 AKT3 MODULATORS AKT3, AKT2, PIK3CA SCN10A 2509/4885KDM4E 4219/4885LMNA 2015/4885
US-20230285569-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF FRAGILE X CYFIP2, TPX2, CYFIP1 SCN10A 1176/4885KDM4E 1660/4885LMNA 1622/4885
US-20230242534-A9 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 AND USES THEREOF CDK2, CDK5, CDK9 SCN10A 3783/4885KDM4E 1465/4885LMNA 1562/4885
US-20090155202-A1 DNA-BINDING POLYMERS PCNA, DDB1, TOP2A SCN10A 4417/4885KDM4E 2859/4885LMNA 2336/4885
US-20100310512-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 SCN10A 4642/4885KDM4E 2496/4885LMNA 1353/4885
US-20090264426-A1 Bicyclic aromatic substituted pyridone derivative PYCR1, CHRM1, MTR SCN10A 3601/4885KDM4E 1819/4885LMNA 520/4885

“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.