SCHEMBL22396147

SCHEMBL22396147

Nc1nc2c(s1)CN(C(=O)c1cc3c(F)c(F)c(F)cc3[nH]1)CC2

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.38
DRD3 P35462 2/20 0.38
POLB P06746 1/20 0.38
HRH4 Q9H3N8 3/20 0.38
GRM5 P41594 2/20 0.38
RAD52 P43351 1/20 0.36
RECQL P46063 1/20 0.36
SCN4A P35499 1/20 0.36
SCN9A Q15858 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
MMP9 P14780 1/20 0.36
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
ABCB1 P08183 3/20 0.35

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
SCHEMBL22396151 0.89 HRH4 (0.46) DRD2DRD3HRH4GRM5MEN1
SCHEMBL22395843 0.88 DRD2 (0.41) DRD2DRD3HRH4GRM5RAD52
SCHEMBL22396258 0.87 MEN1 (0.40) DRD2DRD3POLBHRH4GRM5
SCHEMBL22396118 0.87 FGFR1 (0.38) DRD2DRD3POLBHRH4GRM5
SCHEMBL22396273 0.87 HRH4 (0.40) DRD2DRD3HRH4GRM5RAD52
SCHEMBL22633709 0.86 HRH4 (0.53) DRD2DRD3HRH4GRM5SCN4A
SCHEMBL22633525 0.85 HRH4 (0.57) DRD2DRD3POLBHRH4GRM5
SCHEMBL22395955 0.85 HRH4 (0.39) DRD2DRD3POLBHRH4GRM5
SCHEMBL22633712 0.85 POLB (0.47) DRD2DRD3POLBHRH4GRM5
SCHEMBL22633556 0.84 HRH4 (0.51) DRD2DRD3HRH4GRM5RAD52

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
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
EP-3704127-A1 NOVEL, HIGHLY ACTIVE AMINO-THIAZOLE SUBSTITUTED INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AiCuris GmbH & Co. KG (DE) 2020-09-09 EP 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 DRD2 4223/4885DRD3 4358/4885POLB 895/4885
US-11267825-B2 Highly active amino-thiazole substituted indole-2-carboxamides active against the hepatitis B virus (HBV) HCCS, BRD4, IDO2 DRD2 4367/4885DRD3 4469/4885POLB 655/4885

“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.