SCHEMBL24252511

SCHEMBL24252511

COc1cc(CC(C)C)cc(Cl)n1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35
FAAH O00519 1/20 0.33
MGLL Q99685 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
LOX P28300 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
PDE10A Q9Y233 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
S1PR1 P21453 1/20 0.31

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
SCHEMBL27593885 0.87 ALDH1A1 (0.39) SMN1; SMN2LOXLOXL2PDE10AALDH1A1
SCHEMBL26627240 0.82 ESR1 (0.36) FAAHLMNAHSP90AB1
SCHEMBL17169789 0.81 SMN1; SMN2 (0.38) TAS1R3TAS1R1TAS1R2SMN1; SMN2LOX
Hydrochloric Acid SCHEMBL7451596 0.79 SMN1; SMN2 (0.38) TAS1R3TAS1R1TAS1R2SMN1; SMN2LOX
SCHEMBL13990856 0.79 SMN1; SMN2 (0.41) TAS1R3TAS1R1TAS1R2SMN1; SMN2LOX
SCHEMBL24434490 0.79 S1PR1 (0.33) FAAHMGLLSMN1; SMN2LOXLOXL2
SCHEMBL12988241 0.78 GRM5 (0.35) TAS1R3TAS1R1TAS1R2SMN1; SMN2LOX
SCHEMBL29879916 0.78 RECQL (0.41) TAS1R3TAS1R1TAS1R2SMN1; SMN2LOX
SCHEMBL5897930 0.78 SMN1; SMN2 (0.37) TAS1R3TAS1R1TAS1R2SMN1; SMN2LOX
SCHEMBL2541070 0.78 RECQL (0.41) TAS1R3TAS1R1TAS1R2SMN1; SMN2LOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303494-A1 BENZYLAMINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF ACADEMY OF MILITARY MEDICAL SCIENCES (CN) 2023-09-28 US disclosed
EP-4198017-A1 BENZYLAMINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF Academy of Military Medical Sciences (CN) 2023-06-21 EP disclosed
WO-2022033303-A1 BENZYLAMINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF 中国人民解放军军事科学院军事医学研究院 2022-02-17 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-20230303494-A1 BENZYLAMINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF CD274, PDCD1, PDCD1LG2 TAS1R3 3236/4885TAS1R1 1709/4885TAS1R2 3244/4885

“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.