SCHEMBL29615227

SCHEMBL29615227

O=C(NCCc1ccc(Cl)cc1Cl)Nc1ccc(Cl)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 18/20 1.00
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
KDM4E B2RXH2 1/20 0.58
MEN1 O00255 1/20 0.57
LMNA P02545 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2D6 P10635 1/20 0.57
MAPT P10636 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
HTT P42858 1/20 0.57
KMT2A Q03164 1/20 0.57

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
SCHEMBL22834267 1.00 CNR1 (1.00) CNR1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL4638815 0.85 CNR1 (0.73) CNR1SMN1; SMN2KDM4EMEN1MAPT
SCHEMBL22834258 0.85 CNR1 (1.00) CNR1NPC1RAB9ASMN1; SMN2
SCHEMBL29615069 0.85 CNR1 (1.00) CNR1NPC1RAB9ASMN1; SMN2
SCHEMBL1493027 0.83 CNR1 (0.69) CNR1KDM4E
SCHEMBL11051084 0.81 CNR1 (0.83) CNR1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL3529974 0.80 HPGD (0.67) CNR1KDM4EMEN1LMNAHTT
SCHEMBL22834266 0.80 CNR1 (1.00) CNR1NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL4038474 0.78 HPGD (0.69) CNR1KDM4EMEN1LMNAMAPT
SCHEMBL22834003 0.78 CNR1 (1.00) CNR1NPC1RAB9ASMN1; SMN2MEN1

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-20220332695-A1 UREA DERIVATIVES AS CB1 ALLOSTERIC MODULATORS RESEARCH TRIANGLE INSTITUTE 2022-10-20 US claimed
EP-3990112-A1 UREA DERIVATIVES AS CB1 ALLOSTERIC MODULATORS RTI International (US) 2022-05-04 EP claimed
CN-114269719-A Urea derivatives as CB1 allosteric modulators RTI国际 2022-04-01 CN claimed
US-20220332695-A1 UREA DERIVATIVES AS CB1 ALLOSTERIC MODULATORS RESEARCH TRIANGLE INSTITUTE 2022-10-20 US disclosed
EP-3990112-A1 UREA DERIVATIVES AS CB1 ALLOSTERIC MODULATORS RTI International (US) 2022-05-04 EP disclosed
CN-114269719-A Urea derivatives as CB1 allosteric modulators RTI国际 2022-04-01 CN 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-20220332695-A1 UREA DERIVATIVES AS CB1 ALLOSTERIC MODULATORS CNR1, CNR2, GPR119 CNR1 1/4885NPC1 571/4885RAB9A 1003/4885

“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.