SCHEMBL4518304

SCHEMBL4518304

Cc1cccc(C)c1C1CCN(Cc2c(-c3ccccc3)n(CC(=O)N(C)C3CCN(C)CC3)c3ccccc23)CC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.42
POLB P06746 1/20 0.41
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
OPRM1 P35372 2/20 0.38
OPRL1 P41146 1/20 0.38
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 0.38
CCR5 P51681 3/20 0.38
KCNH2 Q12809 1/20 0.37
MCHR1 Q99705 1/20 0.37
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
TNKS O95271 1/20 0.36
PARP1 P09874 1/20 0.36
HTR2A P28223 1/20 0.36
KMT2A Q03164 1/20 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
SCHEMBL4514740 0.83 HTR2A (0.39) POLBOPRM1OPRL1MCHR1TLR9
SCHEMBL5421524 0.81 ALDH1A1 (0.42) POLBKCNH2MCHR1TLR9HTR2A
Trifluoroacetic Acid SCHEMBL4518616 0.80 MAPT (0.42) POLBLMNAL3MBTL1OPRM1OPRL1
Hydrochloric Acid SCHEMBL5417840 0.80 ALDH1A1 (0.41) POLBKCNH2MCHR1TLR9HTR2A
Trifluoroacetic Acid SCHEMBL4505995 0.80 UBE2N (0.45) POLBLMNAL3MBTL1KMT2A
SCHEMBL5422343 0.79 ALDH1A1 (0.40) KCNH2MCHR1TLR9TLR8TLR7
Hydrochloric Acid SCHEMBL4516561 0.79 TSHR (0.47) CYP3A4POLBLMNATLR9TLR8
Hydrochloric Acid SCHEMBL5425404 0.79 HTR2A (0.40) KCNH2MCHR1TLR9TLR8TLR7
SCHEMBL4779470 0.78 KDM4E (0.42) POLBL3MBTL1OPRM1OPRL1CCR5
SCHEMBL5430462 0.78 HTR2A (0.50) KCNH2HTR2AKMT2A

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-20090275555-A1 Substituted indole ligands for the ORL-1 receptor BRANE DISCOVERY S.R.L. (IT) 2009-11-05 US claimed
EP-1841755-A1 SUBSTITUTED INDOLE LIGANDS FOR THE ORL-1 RECEPTOR BRANE DISCOVERY S.R.L. (IT) 2007-10-10 EP claimed
WO-2006070001-A1 SUBSTITUTED INDOLE LIGANDS FOR THE ORL-1 RECEPTOR BRANE DISCOVERY S.R.L. (IT) 2006-07-06 WO claimed
US-20090275555-A1 Substituted indole ligands for the ORL-1 receptor BRANE DISCOVERY S.R.L. (IT) 2009-11-05 US disclosed
EP-1841755-A1 SUBSTITUTED INDOLE LIGANDS FOR THE ORL-1 RECEPTOR BRANE DISCOVERY S.R.L. (IT) 2007-10-10 EP disclosed
WO-2006070001-A1 SUBSTITUTED INDOLE LIGANDS FOR THE ORL-1 RECEPTOR BRANE DISCOVERY S.R.L. (IT) 2006-07-06 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-20090275555-A1 Substituted indole ligands for the ORL-1 receptor OGFRL1, OPRL1, ORMDL3 CYP3A4 1102/4885POLB 4604/4885LMNA 4213/4885

“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.