SCHEMBL7329753

SCHEMBL7329753

OCc1ccc(CN2CCCCC2)o1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.55
GAA P10253 1/20 0.55
HRH3 Q9Y5N1 3/20 0.47
ACHE P22303 1/20 0.44
ALDH1A1 P00352 5/20 0.43
NPC1 O15118 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
HTT P42858 1/20 0.42
HRH4 Q9H3N8 1/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL28811140 0.98 KDM4E (0.53) KDM4EGAAHRH3ACHEALDH1A1
SCHEMBL11186313 0.90 ALDH1A1 (0.50) KDM4EGAAALDH1A1NPC1SMN1; SMN2
SCHEMBL4143256 0.83 HTT (0.61) HRH3ALDH1A1CYP3A4CYP2C9SMN1; SMN2
SCHEMBL11523316 0.82 ALDH1A1 (0.41) KDM4EGAAALDH1A1NPC1NPSR1
SCHEMBL4144775 0.81 ALDH1A1 (0.55) KDM4EALDH1A1NPC1SMN1; SMN2NPSR1
SCHEMBL24160846 0.81 KDM4E (0.51) KDM4EGAAHRH3ACHEALDH1A1
SCHEMBL13990823 0.81 KDM4E (0.51) KDM4EGAAHRH3ACHEALDH1A1
SCHEMBL9840022 0.81 KDM4E (0.51) KDM4EGAAHRH3ACHEALDH1A1
SCHEMBL9840017 0.81 KDM4E (0.51) KDM4EGAAHRH3ACHEALDH1A1
SCHEMBL14375213 0.79 ACHE (0.49) HRH3ACHEALDH1A1NPSR1HRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220143002-A1 SULFUR-CONTAINING COMPOUND BASED ON GLUTARIMIDE SKELETON AND APPLICATION THEREOF SHANGHAITECH UNIVERSITY (CN) 2022-05-12 US disclosed
EP-3932922-A1 SULFUR-CONTAINING COMPOUND BASED ON GLUTARIMIDE SKELETON AND APPLICATION THEREOF ShanghaiTech University (CN) 2022-01-05 EP disclosed
US-5017586-A 5-dialkylaminomethyl-2-furanomethanol derivatives having anti-hypertensive properties GEROT-PHARMAZEUTIKA GESELLSCHAFT M.B.H. (AT) 1991-05-21 US disclosed
EP-0342182-A1 Derivatives of 5-aminomethyl-2-furan methanol, their preparation and use Gerot-Pharmazeutika Gesellschaft m.b.H. (AT) 1989-11-15 EP disclosed
US-4837316-A ANTIULCER AGENTS FUJIREBIO KABUSHIKI KAISHA (JP) 1989-06-06 US disclosed
EP-0214823-A2 Alkylamide derivatives with H2-receptor antagonistic and cytoprotective action FUJIREBIO KABUSHIKI KAISHA also trading as FUJIREBIO INC. (JP) 1987-03-18 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 (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-20220143002-A1 SULFUR-CONTAINING COMPOUND BASED ON GLUTARIMIDE SKELETON AND APPLICATION THEREOF GLS, SQOR, GCDH KDM4E 3516/4885GAA 617/4885HRH3 4801/4885

“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.