SCHEMBL22633556

SCHEMBL22633556

Nc1nc2c(s1)CN(C(=O)c1cc3c(F)ccc(F)c3[nH]1)CC2

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 6/20 0.51
GRM5 P41594 6/20 0.40
DPP4 P27487 3/20 0.40
DPP8 Q6V1X1 3/20 0.40
DPP9 Q86TI2 3/20 0.40
DPP7 Q9UHL4 3/20 0.40
DRD2 P14416 2/20 0.37
DRD3 P35462 2/20 0.37
RAD52 P43351 1/20 0.37
RECQL P46063 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
SCHEMBL22396024 0.94 HRH4 (0.47) HRH4GRM5DPP4DPP8DPP9
SCHEMBL22396027 0.93 HRH4 (0.44) HRH4GRM5DPP4DPP8DPP9
SCHEMBL22396346 0.93 HRH4 (0.44) HRH4GRM5DPP4DPP8DPP9
SCHEMBL22395875 0.92 HRH4 (0.45) HRH4GRM5DPP4DPP8DPP9
SCHEMBL22633558 0.92 HRH4 (0.43) HRH4GRM5DPP4DPP8DPP9
SCHEMBL22396058 0.91 HRH4 (0.42) HRH4GRM5DPP4DPP8DPP9
SCHEMBL22396190 0.90 HRH4 (0.44) HRH4GRM5DPP4DPP8DPP9
SCHEMBL22633777 0.90 HRH4 (0.44) HRH4GRM5DPP4DPP8DPP9
SCHEMBL22396273 0.90 HRH4 (0.40) HRH4GRM5DPP4DPP8DPP9
SCHEMBL22395902 0.88 HRH4 (0.52) HRH4GRM5DPP4DPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11267825-B2 Highly active amino-thiazole substituted indole-2-carboxamides active against the hepatitis B virus (HBV) AICURIS GMBH & CO. KG (DE) 2022-03-08 US disclosed
US-20200354379-A1 NOVEL, HIGHLY ACTIVE AMINO-THIAZOLE SUBSTITUTED INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2020-11-12 US disclosed
US-20200354379-A1 NOVEL, HIGHLY ACTIVE AMINO-THIAZOLE SUBSTITUTED INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2020-11-12 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 (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-20200354379-A1 NOVEL, HIGHLY ACTIVE AMINO-THIAZOLE SUBSTITUTED INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) HCCS, CDK2, BRD4 HRH4 1649/4885GRM5 3507/4885DPP4 1177/4885
US-11267825-B2 Highly active amino-thiazole substituted indole-2-carboxamides active against the hepatitis B virus (HBV) HCCS, BRD4, IDO2 HRH4 1490/4885GRM5 3346/4885DPP4 1069/4885

“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.