SCHEMBL24458028

SCHEMBL24458028

CCCNc1ccc2nn(-c3ccc(Cl)cc3)nc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.55
MAPT P10636 8/20 0.53
TP53 P04637 2/20 0.53
NPC1 O15118 9/20 0.52
RAB9A P51151 7/20 0.52
KDM4E B2RXH2 4/20 0.52
ATM Q13315 2/20 0.52
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
RORC P51449 1/20 0.47
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 2/20 0.42
THRB P10828 1/20 0.42
NR1I2 O75469 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
SCHEMBL24458202 0.89 RXFP1 (0.57) RXFP1MAPTTP53NPC1RAB9A
SCHEMBL24457930 0.85 RXFP1 (0.52) RXFP1MAPTTP53NPC1RAB9A
SCHEMBL24458010 0.82 RXFP1 (0.54) RXFP1MAPTTP53NPC1RAB9A
SCHEMBL24458039 0.81 RXFP1 (0.60) RXFP1MAPTTP53NPC1RAB9A
SCHEMBL24458043 0.81 MAPT (0.54) RXFP1MAPTTP53NPC1RAB9A
SCHEMBL24458002 0.81 NPC1 (0.59) RXFP1MAPTTP53NPC1RAB9A
SCHEMBL24458038 0.78 RXFP1 (0.53) RXFP1MAPTTP53NPC1RAB9A
SCHEMBL3219219 0.78 MAPT (0.78) RXFP1MAPTTP53NPC1RAB9A
SCHEMBL2244769 0.77 NPC1 (0.77) RXFP1MAPTTP53NPC1RAB9A
SCHEMBL24458060 0.77 NPC1 (0.55) RXFP1MAPTTP53NPC1RAB9A

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 4 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
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 RXFP1 2379/4885MAPT 2173/4885TP53 1119/4885

“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.