SCHEMBL21775993

SCHEMBL21775993

O=C(Nc1cccc(O)c1)c1cccc(C(=O)Nc2cccc(O)c2)n1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.68
MEN1 O00255 4/20 0.64
KMT2A Q03164 4/20 0.64
ALDH1A1 P00352 3/20 0.58
CYP1A2 P05177 1/20 0.58
NPC1 O15118 5/20 0.57
RAB9A P51151 4/20 0.57
MAPK1 P28482 2/20 0.57
TP53 P04637 1/20 0.57
SRC P12931 1/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
LMNA P02545 3/20 0.54
MAPT P10636 2/20 0.54
GAA P10253 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
KDM4E B2RXH2 1/20 0.53
RECQL P46063 1/20 0.53
MCL1 Q07820 1/20 0.53
TDP1 Q9NUW8 1/20 0.53

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
SCHEMBL28610155 0.92 POLB (0.58) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL2528081 0.85 GRM4 (0.72) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL15347911 0.81 POLB (1.00) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL11675529 0.78 MEN1 (1.00) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL29800565 0.78 MEN1 (0.93) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL6793906 0.78 MEN1 (0.93) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL8267293 0.78 SMN1; SMN2 (0.74) MEN1KMT2AALDH1A1CYP1A2NPC1
SCHEMBL23309680 0.77 MEN1 (0.66) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL31432059 0.77 GRM4 (0.66) POLBMEN1KMT2AALDH1A1NPC1
SCHEMBL13561074 0.77 KMT2A (0.72) POLBMEN1KMT2AALDH1A1RAB9A

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
EP-3841097-B1 2,6-BIS(((1H-BENZO[D]IMIDAZOL-2-YL)THIO)METHYL)PYRIDINE AND N2,N6-DIBENZYLPYRIDINE-2,6-DICARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS PHOSPHOINOSITIDE 3-KINASE (PI3K) INHIBITORS FOR TREATING CANCER BIOMEDICAL RES FOUNDATION OF THE ACADEMY OF ATHENS BRFAA (GR) 2026-05-20 EP disclosed
US-20210246120-A1 METHOD OF PREPARATION AND USE OF PHOSPHOINOSITIDE 3-KINASE INHIBITORS IN TREATING CANCER FOUNDATION FOR RESEARCH AND TECHNOLOGY HELLAS (FORTH) (GR) 2021-08-12 US disclosed
WO-2020039097-A1 2,6-BIS(((1H-BENZO[D]IMIDAZOL-2-YL)THIO)METHYL)PYRIDINE AND N2,N6-DIBENZYLPYRIDINE-2,6-DICARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS PHOSPHOINOSITIDE 3-KINASE (PI3K) INHIBITORS FOR TREATING CANCER BIOMEDICAL RESEARCH FOUNDATION OF THE ACADEMY OF ATHENS (BRFAA) (GR) 2020-02-27 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-20210246120-A1 METHOD OF PREPARATION AND USE OF PHOSPHOINOSITIDE 3-KINASE INHIBITORS IN TREATING CANCER PIK3R3, PIK3CA, PIK3C2A POLB 2504/4885MEN1 4234/4885KMT2A 3548/4885

“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.