SCHEMBL30589255

SCHEMBL30589255

COCCN(Cc1ccccn1)C(=O)Cc1c(-c2ccc(Cl)cc2)nc2cc(C)ccn12

nearest known ligand 0.85

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TSPO P30536 3/20 0.52
▸ NR1I2 O75469 1/20 0.47
▸ ABCB11 O95342 1/20 0.47
▸ ALB P02768 1/20 0.47
▸ ADORA3 P0DMS8 1/20 0.47
▸ ADORA1 P30542 1/20 0.47
▸ OPRM1 P35372 1/20 0.47
▸ DRD3 P35462 1/20 0.47
▸ OPRK1 P41145 1/20 0.47
▸ PDE4D Q08499 1/20 0.47
▸ KCNH2 Q12809 1/20 0.47
▸ GABRA2 P47869 1/20 0.45
▸ GABRB2 P47870 1/20 0.45

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
SCHEMBL14889133 1.00 TSPO (0.52) TSPONR1I2ABCB11ALBADORA3
Hydrochloric Acid SCHEMBL14889244 0.99 TSPO (0.51) TSPONR1I2ABCB11ALBADORA3
SCHEMBL30589252 0.94 TSPO (0.45) TSPOALBOPRK1KCNH2GABRA2
SCHEMBL14889211 0.94 TSPO (0.45) TSPOALBOPRK1KCNH2GABRA2
Hydrochloric Acid SCHEMBL14889118 0.93 TSPO (0.44) TSPOALBOPRK1KCNH2GABRA2
SCHEMBL14899704 0.92 TSPO (0.44) TSPOGABRA2GABRB2
SCHEMBL15158408 0.92 TSPO (0.47) TSPO
Hydrochloric Acid SCHEMBL14889138 0.91 TSPO (0.43) TSPOGABRA2GABRB2
Hydrochloric Acid SCHEMBL14889126 0.91 TSPO (0.46) TSPO
SCHEMBL12071924 0.89 TSPO (0.55) TSPONR1I2ABCB11ALBADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230293537-A1 USE OF ACETAMIDE DERIVATIVE IN PREVENTION AND TREATMENT OF ALZHEIMER'S DISEASE ACADEMY OF MILITARY MEDICAL SCIENCES (CN) 2023-09-21 — — US claimed
US-20230293537-A1 USE OF ACETAMIDE DERIVATIVE IN PREVENTION AND TREATMENT OF ALZHEIMER'S DISEASE ACADEMY OF MILITARY MEDICAL SCIENCES (CN) 2023-09-21 — — 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-20230293537-A1 USE OF ACETAMIDE DERIVATIVE IN PREVENTION AND TREATMENT OF ALZHEIMER'S DISEASE ACHE, APP, NAAA TSPO 1344/4885NR1I2 1357/4885ABCB11 1023/4885

“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.

Send feedback