SCHEMBL25307122

SCHEMBL25307122

Nc1nc2ccc(-c3ccc(C(F)(F)F)nc3)cc2s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 18/20 1.00
PI4KB Q9UBF8 18/20 1.00
PIK3CA P42336 17/20 1.00
PIK3CD O00329 15/20 1.00
PIK3CB P42338 14/20 1.00
PIK3CG P48736 13/20 1.00
PIP5K1C O60331 6/20 0.60
ALKBH5 Q6P6C2 1/20 0.58
FTO Q9C0B1 1/20 0.58
EPHX2 P34913 1/20 0.56
SCN4A P35499 1/20 0.56

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
SCHEMBL31114551 1.00 PI4KA (1.00) PI4KAPI4KBPIK3CAPIK3CDPIK3CB
SCHEMBL25304259 0.81 PI4KA (0.69) PI4KAPI4KBPIK3CAPIK3CDPIK3CB
SCHEMBL31114760 0.81 PI4KA (0.69) PI4KAPI4KBPIK3CAPIK3CDPIK3CB
SCHEMBL25493442 0.81 PI4KA (0.67) PI4KAPI4KBPIK3CAPIK3CDPIK3CB
SCHEMBL29646253 0.80 PIK3CA (0.82) PI4KAPI4KBPIK3CAPIK3CDPIK3CB
SCHEMBL5532470 0.80 PIK3CA (0.82) PI4KAPI4KBPIK3CAPIK3CDPIK3CB
SCHEMBL17969171 0.80 SCN4A (0.77) PI4KAPI4KBPIK3CAPIK3CDPIK3CB
SCHEMBL19253768 0.77 PIK3CD (0.62) PI4KAPI4KBPIK3CAPIK3CDPIK3CB
SCHEMBL3708484 0.77 SCN4A (0.62) PI4KAPI4KBPIK3CAPIK3CDPIK3CB
SCHEMBL31114667 0.76 SCN4A (0.70) PI4KAPI4KBPIK3CAPIK3CDPIK3CB

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-20250382273-A1 BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS INST NAT SANTE RECH MED (FR) 2025-12-18 US disclosed
EP-4460500-A1 BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE - INSERM (FR) 2024-11-13 EP disclosed
WO-2023131649-A1 BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2023-07-13 WO disclosed
WO-2023131649-A1 BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2023-07-13 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-20250382273-A1 BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS BBOX1, NDUFB6, NDUFB5 PI4KA 4333/4885PI4KB 3022/4885PIK3CA 3378/4885

“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.