SCHEMBL24458029

SCHEMBL24458029

CCN(C)c1ccc2nn(-c3ccc(Cl)cc3)nc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.54
RAB9A P51151 9/20 0.54
MAPT P10636 7/20 0.54
ATM Q13315 3/20 0.54
KDM4E B2RXH2 3/20 0.54
MEN1 O00255 8/20 0.48
KMT2A Q03164 8/20 0.48
RXFP1 Q9HBX9 1/20 0.44
TP53 P04637 5/20 0.43
PKM P14618 1/20 0.41
ALDH1A1 P00352 4/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
HSD17B10 Q99714 3/20 0.40
GAA P10253 2/20 0.40
CASP1 P29466 2/20 0.40
CASP7 P55210 2/20 0.40
ALOX5 P09917 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
SCHEMBL24458194 0.87 MAPT (0.55) NPC1RAB9AMAPTATMKDM4E
SCHEMBL24458154 0.85 NPC1 (0.59) NPC1RAB9AMAPTATMKDM4E
SCHEMBL24458112 0.83 MAPT (0.48) NPC1RAB9AMAPTATMKDM4E
SCHEMBL10999725 0.81 NPC1 (0.51) NPC1RAB9AMAPTATMKDM4E
SCHEMBL3042432 0.79 NPC1 (0.55) NPC1RAB9AMAPTATMKDM4E
SCHEMBL10999006 0.77 TERT (0.51) NPC1RAB9AMAPTATMKDM4E
SCHEMBL3221606 0.74 NPC1 (0.54) NPC1RAB9AMAPTATMKDM4E
SCHEMBL23667959 0.74 NPC1 (0.50) NPC1RAB9AMAPTATMKDM4E
SCHEMBL22686633 0.73 KDM4E (0.53) NPC1RAB9AMAPTATMKDM4E
SCHEMBL28756192 0.73 NPC1 (0.65) NPC1RAB9AMAPTATMKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116438176-A 2-phenylbenzotriazol-5-amine derivatives for the treatment and prevention of Hepatitis B Virus (HBV) infection 豪夫迈·罗氏有限公司 2023-07-14 CN claimed
US-20230286927-A1 2-PHENYLBENZOTRIAZOL-5-AMINE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS (HBV) INFECTION HOFFMANN-LA ROCHE INC. (US) 2023-09-14 US disclosed
US-20230286927-A1 2-PHENYLBENZOTRIAZOL-5-AMINE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS (HBV) INFECTION HOFFMANN-LA ROCHE INC. (US) 2023-09-14 US disclosed
CN-116438176-A 2-phenylbenzotriazol-5-amine derivatives for the treatment and prevention of Hepatitis B Virus (HBV) infection 豪夫迈·罗氏有限公司 2023-07-14 CN disclosed
WO-2022106588-A1 2-PHENYLBENZOTRIAZOL-5-AMINE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS (HBV) INFECTION F. HOFFMANN-LA ROCHE AG (CH) 2022-05-27 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 (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-20230286927-A1 2-PHENYLBENZOTRIAZOL-5-AMINE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS (HBV) INFECTION HAVCR2, NR1H4, SLC10A1 NPC1 274/4885RAB9A 1884/4885MAPT 2173/4885

“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.