SCHEMBL5535594

SCHEMBL5535594

CCCc1nc2ccc(C)cc2o1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.83
KDM4E B2RXH2 5/20 0.83
NPC1 O15118 7/20 0.57
RAB9A P51151 7/20 0.57
SMN1; SMN2 Q16637 5/20 0.57
USP2 O75604 1/20 0.57
MAPK10 P53779 1/20 0.57
HSD17B10 Q99714 3/20 0.50
ALDH1A1 P00352 5/20 0.47
HPGD P15428 4/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 1/20 0.46
TP53 P04637 3/20 0.45
PKM P14618 1/20 0.45
ELANE P08246 1/20 0.44
AAK1 Q2M2I8 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43

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
SCHEMBL21814905 0.90 KDM4E (0.78) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL5538663 0.86 KDM4E (0.62) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL5540534 0.86 KDM4E (0.77) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL26554870 0.85 KDM4E (0.81) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL26554875 0.82 KDM4E (0.76) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL14619107 0.81 MAPT (0.56) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL17232968 0.81 MAPT (0.56) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL5535590 0.81 MAPT (0.56) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL29802262 0.81 MAPT (0.56) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL104801 0.81 KDM4E (0.73) MAPTKDM4ENPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295114-A1 AKT3 MODULATORS Georgiamune Inc. 2023-09-21 US disclosed
US-20170066732-A1 ANTI-ENTEROVIRUS 71 THIADIAZOLIDINE DERIVATIVE Jiangsu Kanion pharmaceutical CO. LTD (CN) 2017-03-09 US disclosed
WO-2015165340-A1 ANTI-ENTEROVIRUS 71 THIADIAZOLIDINE DERIVATIVE 南京明德新药研发股份有限公司 2015-11-05 WO disclosed
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-05-04 US disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP 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 (3 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-20230295114-A1 AKT3 MODULATORS AKT3, AKT2, MTOR MAPT 3962/4885KDM4E 3961/4885NPC1 1106/4885
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 MAPT 4117/4885KDM4E 4854/4885NPC1 2404/4885
US-20170066732-A1 ANTI-ENTEROVIRUS 71 THIADIAZOLIDINE DERIVATIVE EIF2AK2, GTF3C5, GTF3C1 MAPT 3673/4885KDM4E 2783/4885NPC1 1136/4885

“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.