SCHEMBL1424929

SCHEMBL1424929

c1ccc(-c2nnc(-c3ccccn3)s2)nc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 1.00
RAB9A P51151 7/20 1.00
NPC1 O15118 7/20 1.00
MAPT P10636 2/20 1.00
ATM Q13315 1/20 1.00
GLA P06280 1/20 0.60
LMNA P02545 3/20 0.59
CCR1 P32246 2/20 0.59
CCR5 P51681 2/20 0.59
CCR8 P51685 2/20 0.59
CYP1A2 P05177 1/20 0.59
POLB P06746 1/20 0.59
METAP1 P53582 1/20 0.59
BLM P54132 1/20 0.59
HIF1A Q16665 1/20 0.59
DOHH Q9BU89 1/20 0.59
P4HTM Q9NXG6 1/20 0.59
SMN1; SMN2 Q16637 8/20 0.57
TP53 P04637 6/20 0.57
HSD17B10 Q99714 6/20 0.57

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
SCHEMBL15671504 0.87 KDM4E (0.77) KDM4ERAB9ANPC1MAPTATM
SCHEMBL29870798 0.87 KDM4E (0.77) KDM4ERAB9ANPC1MAPTATM
SCHEMBL11982530 0.86 KDM4E (0.74) KDM4ERAB9ANPC1MAPTATM
SCHEMBL1107860 0.86 KDM4E (0.74) KDM4ERAB9ANPC1MAPTATM
SCHEMBL17135790 0.86 KDM4E (0.74) KDM4ERAB9ANPC1MAPTATM
SCHEMBL8143194 0.86 KDM4E (0.74) KDM4ERAB9ANPC1MAPTATM
SCHEMBL1098775 0.86 KDM4E (0.74) KDM4ERAB9ANPC1MAPTATM
SCHEMBL971007 0.86 KDM4E (0.74) KDM4ERAB9ANPC1MAPTATM
SCHEMBL1208215 0.84 KDM4E (0.70) KDM4ERAB9ANPC1MAPTATM
SCHEMBL22761302 0.82 KDM4E (0.69) KDM4ERAB9ANPC1MAPTATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120535765-A Three-dimensional cobalt-based MOF material, preparation method thereof and application thereof in conversion of carbon dioxide into oxazolidinone derivatives 太原师范学院 2025-08-26 CN disclosed
US-20250186411-A1 Methods of Treating Disorders Associated with Overactivation of IKKB US GOV VETERANS AFFAIRS (US) 2025-06-12 US disclosed
US-8598208-B2 Pyridine derivatives as S1P1/EDG1 receptor modulators ACTELION PHARMACEUTICALS LTD. (CH) 2013-12-03 US disclosed
US-20110212998-A1 PYRIDINE DERIVATIVES AS S1P1/EDG1 RECEPTOR MODULATORS ACTELION PHARMACEUTICALS LTD. (CH) 2011-09-01 US disclosed
EP-2195311-B1 PYRIDINE DERIVATIVES AS S1P1/EDG1 RECEPTOR MODULATORS ACTELION PHARMACEUTICALS LTD (CH) 2011-03-23 EP disclosed
EP-2195311-A1 PYRIDINE DERIVATIVES AS S1P1/EDG1 RECEPTOR MODULATORS Actelion Pharmaceuticals Ltd. (CH) 2010-06-16 EP disclosed
WO-2009024905-A1 PYRIDINE DERIVATIVES AS S1P1/EDG1 RECEPTOR MODULATORS ACTELION PHARMACEUTICALS LTD (CH) 2009-02-26 WO disclosed
US-4853396-A 2,5-BIS(PYRIDYL)-1,3,4-THIADIAZOLES CIBA-GEIGY CORPORATION (US) 1989-08-01 US disclosed
US-4853396-A 2,5-BIS(PYRIDYL)-1,3,4-THIADIAZOLES CIBA-GEIGY CORPORATION (US) 1989-08-01 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-20250186411-A1 Methods of Treating Disorders Associated with Overactivation of IKKB NFKBIA, IKBKG, IKBKB KDM4E 2712/4885RAB9A 3272/4885NPC1 1123/4885
US-20110212998-A1 PYRIDINE DERIVATIVES AS S1P1/EDG1 RECEPTOR MODULATORS S1PR1, S1PR3, S1PR2 KDM4E 919/4885RAB9A 2456/4885NPC1 1256/4885

“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.