SCHEMBL5361607

SCHEMBL5361607

[O]C(=O)c1cc2ccccc2nn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 7/20 0.43
HPGD P15428 4/20 0.43
MAPT P10636 3/20 0.43
GLA P06280 2/20 0.43
ACHE P22303 1/20 0.43
MGAM O43451 2/20 0.42
IKBKB O14920 1/20 0.41
CNR2 P34972 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GAA P10253 2/20 0.37
STAT3 P40763 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
NQO2 P16083 1/20 0.37
RAB9A P51151 1/20 0.37
CFTR P13569 1/20 0.36
HSD17B10 Q99714 2/20 0.36

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
SCHEMBL3660080 0.86 MGAM (0.57) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL30212114 0.86 MGAM (0.57) KDM4EALDH1A1HPGDMAPTGLA
Water SCHEMBL28321872 0.84 MGAM (0.55) KDM4EALDH1A1HPGDMAPTGLA
Hydrochloric Acid SCHEMBL10514366 0.84 MGAM (0.55) KDM4EALDH1A1HPGDMAPTGLA
Ammonia Solution, Strong SCHEMBL9496314 0.84 MGAM (0.55) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL30824210 0.82 KDM4E (0.43) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL965159 0.82 IKBKB (0.51) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL2007758 0.82 KDM4E (0.43) KDM4EALDH1A1HPGDMAPTGLA
SCHEMBL10514362 0.82 KDM4E (0.43) KDM4EALDH1A1HPGDMAPTGLA
Hydrochloric Acid SCHEMBL27798246 0.81 IKBKB (0.50) KDM4EALDH1A1HPGDMAPTGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4371979-A1 FORMAMIDE DERIVATIVE AND AGRICULTURAL OR HORTICULTURAL PLANT DISEASE CONTROL AGENT Kumiai Chemical Industry Co., Ltd. (JP) 2024-05-22 EP disclosed
WO-2023286855-A1 FORMAMIDE DERIVATIVE AND AGRICULTURAL OR HORTICULTURAL PLANT DISEASE CONTROL AGENT クミアイ化学工業株式会社 2023-01-19 WO disclosed
US-7217723-B2 Substituted benzothiophenes, e.g., 7Z)-7-hydroxyimino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-sulfonic acid [2-(4-fluorophenyl)-2-hydroxyethyl]-methyl-amide; treating allergies such as atopic dermatitis, allergic coryza, bronchial asthma, hypersensitive pneumoniac and pulmonary aspergillosis. EISAI CO., LTD. (JP) 2007-05-15 US disclosed
US-20050227959-A1 Heterocyclic compound having oxime group EISAI CO., LTD. (JP) 2005-10-13 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 (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-20050227959-A1 Heterocyclic compound having oxime group STAT6, HRH4, HRH2 KDM4E 855/4885ALDH1A1 1391/4885HPGD 1479/4885

“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.