SCHEMBL21186294

SCHEMBL21186294

Nc1nc2ccc(Oc3ccnc(C(F)(F)F)c3)cc2s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.59
CYP3A4 P08684 5/20 0.59
NPC1 O15118 3/20 0.59
TP53 P04637 3/20 0.59
HSD17B10 Q99714 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
CYP1A2 P05177 2/20 0.59
SCN4A P35499 2/20 0.59
LMNA P02545 2/20 0.59
PKM P14618 2/20 0.59
MAPT P10636 2/20 0.59
HTT P42858 2/20 0.59
GAA P10253 2/20 0.59
GMNN O75496 1/20 0.59
USP2 O75604 1/20 0.59
ADORA3 P0DMS8 1/20 0.59
CYP2C9 P11712 1/20 0.59
ALOX15 P16050 1/20 0.59
NFKB1 P19838 1/20 0.59
SLC6A2 P23975 1/20 0.59

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
SCHEMBL30450788 1.00 RAB9A (0.59) RAB9ACYP3A4NPC1TP53HSD17B10
SCHEMBL14396681 0.82 CYP3A4 (0.48) RAB9ACYP3A4NPC1TP53HSD17B10
SCHEMBL20568080 0.82 RAB9A (0.84) RAB9ACYP3A4NPC1TP53HSD17B10
SCHEMBL18004108 0.81 SCN4A (0.70) RAB9ACYP3A4NPC1TP53HSD17B10
SCHEMBL30451659 0.81 SCN4A (0.70) RAB9ACYP3A4NPC1TP53HSD17B10
SCHEMBL14397008 0.80 RAB9A (0.63) RAB9ACYP3A4NPC1TP53HSD17B10
SCHEMBL31114535 0.80 RAB9A (0.63) RAB9ACYP3A4NPC1TP53HSD17B10
SCHEMBL25259629 0.80 SCN4A (0.60) RAB9ACYP3A4NPC1TP53HSD17B10
SCHEMBL30450219 0.80 SCN4A (0.60) RAB9ACYP3A4NPC1TP53HSD17B10
SCHEMBL25306149 0.79 RAB9A (0.75) RAB9ACYP3A4NPC1TP53HSD17B10

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
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
WO-2019141980-A1 AGRICULTURAL CHEMICALS GLOBACHEM NV (BE) 2019-07-25 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 RAB9A 2727/4885CYP3A4 343/4885NPC1 3115/4885

“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.