SCHEMBL3370649

SCHEMBL3370649

N#Cc1c(Cl)cccc1Oc1ccc(-c2cc[nH]n2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 4/20 0.57
MAPT P10636 2/20 0.47
KDM4E B2RXH2 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
HSD11B1 P28845 1/20 0.44
BCL2L1 Q07817 1/20 0.43
MCL1 Q07820 1/20 0.43
LMNA P02545 2/20 0.36
ADRB2 P07550 2/20 0.36
SMOX Q9NWM0 1/20 0.35
MEN1 O00255 3/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 3/20 0.35
KMT2A Q03164 3/20 0.35
ADORA2A P29274 2/20 0.34
ADORA1 P30542 2/20 0.34
ERBB2 P04626 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
AR P10275 1/20 0.34

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
SCHEMBL12780756 0.83 TLR8 (0.67) TLR8MAPTKDM4ESMN1; SMN2HSD11B1
SCHEMBL3370644 0.81 TLR8 (0.41) TLR8MAPTKDM4ESMN1; SMN2HSD11B1
SCHEMBL3367910 0.78 TLR8 (0.55) TLR8MAPTKDM4ESMN1; SMN2HSD11B1
SCHEMBL12122765 0.76 TLR8 (0.58) TLR8MAPTKDM4ESMN1; SMN2HSD11B1
SCHEMBL3370903 0.76 TLR8 (0.56) TLR8MAPTKDM4ESMN1; SMN2HSD11B1
SCHEMBL6177743 0.75 TLR8 (0.56) TLR8MAPTKDM4EHSD11B1BCL2L1
SCHEMBL22169507 0.75 HSD11B1 (0.57) TLR8MAPTKDM4EHSD11B1BCL2L1
SCHEMBL2628123 0.74 TLR8 (0.56) TLR8MAPTKDM4ESMN1; SMN2HSD11B1
SCHEMBL11508991 0.73 TLR8 (0.52) TLR8MAPTKDM4ESMN1; SMN2HSD11B1
SCHEMBL3364662 0.73 TLR8 (0.50) TLR8MAPTKDM4ESMN1; SMN2HSD11B1

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
EP-2266960-B1 Aryl-substituted pyrazoles, imidazoles, oxazoles, thiazoles and pyrroles as anticonvulsants EURO CELTIQUE SA (LU) 2014-01-22 EP disclosed
EP-2266960-A2 Aryl-substituted pyrazoles, imidazoles, oxazoles, thiazoles and pyrroles as anticonvulsants EURO-CELTIQUE S.A. (LU) 2010-12-29 EP disclosed
EP-1173169-B1 ARYL SUBSTITUTED PYRAZOLES, IMIDAZOLES, OXAZOLES, THIAZOLES AND PYRROLES, AND THE USE THEREOF EURO CELTIQUE SA (LU) 2010-05-12 EP disclosed
EP-1173169-A4 ARYL SUBSTITUTED PYRAZOLES, IMIDAZOLES, OXAZOLES, THIAZOLES AND PYRROLES, AND THE USE THEREOF EURO CELTIQUE SA (LU) 2007-04-04 EP disclosed
US-6737418-B2 CENTRAL NERVOUS SYSTEM DISORDERS; ANTICONVULSANTS EURO-CELTIQUE S.A. (LU) 2004-05-18 US disclosed
US-20030069292-A1 Aryl substituted pyrazoles, imidazoles, oxazoles, thiazoles and pyrroles, and the use thereof EURO-CELTIQUE S.A. 2003-04-10 US disclosed
US-6414011-B1 CENTRAL NERVOUS SYSTEM DISORDERS EURO-CELTIQUE S.A. (LU) 2002-07-02 US disclosed
EP-1173169-A1 ARYL SUBSTITUTED PYRAZOLES, IMIDAZOLES, OXAZOLES, THIAZOLES AND PYRROLES, AND THE USE THEREOF Euro-Celtique S.A. (LU) 2002-01-23 EP disclosed
WO-2000057877-A1 ARYL SUBSTITUTED PYRAZOLES, IMIDAZOLES, OXAZOLES, THIAZOLES AND PYRROLES, AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2000-10-05 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-20030069292-A1 Aryl substituted pyrazoles, imidazoles, oxazoles, thiazoles and pyrroles, and the use thereof GRIK5, GRIN3A, GRIK3 TLR8 2722/4885MAPT 454/4885KDM4E 2557/4885

“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.