SCHEMBL4515176

SCHEMBL4515176

O=C(c1ccccc1)N1CCN(C(=O)c2[nH]c3ccccc3c2CN2CCC(c3c(Cl)cccc3Cl)CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.46
HTR2A P28223 2/20 0.44
MCL1 Q07820 3/20 0.43
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 2/20 0.42
HPGD P15428 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HSD17B10 Q99714 3/20 0.42
NPSR1 Q6W5P4 3/20 0.42
MAPK10 P53779 2/20 0.42
USP2 O75604 1/20 0.42
MAPT P10636 3/20 0.42
HTT P42858 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ADRB2 P07550 1/20 0.42
DRD2 P14416 1/20 0.42
PRSS12 P56730 1/20 0.42
TSHR P16473 2/20 0.42
MAPK1 P28482 1/20 0.42

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
Hydrochloric Acid SCHEMBL4525039 0.92 HTR2A (0.51) LMNAHTR2AMCL1ALDH1A1KDM4E
SCHEMBL4520883 0.91 HRH4 (0.49) HTR2AMCL1ALDH1A1KDM4EHPGD
SCHEMBL4529569 0.90 HTR2A (0.43) HTR2AMCL1ALDH1A1KDM4EHPGD
SCHEMBL4528863 0.89 HTR2A (0.41) HTR2AMCL1ALDH1A1KDM4EHPGD
Hydrochloric Acid SCHEMBL4522613 0.89 HTR2A (0.42) HTR2AMCL1ALDH1A1KDM4EHPGD
Hydrochloric Acid SCHEMBL4513138 0.88 HTR2A (0.48) HTR2AALDH1A1KDM4EMAPTHTT
SCHEMBL4531335 0.88 KMT2A (0.41) HTR2AMCL1ALDH1A1KDM4EHPGD
SCHEMBL4510872 0.88 HRH3 (0.43) HTR2AMCL1ALDH1A1KDM4EHPGD
Hydrochloric Acid SCHEMBL4516276 0.88 MCL1 (0.49) LMNAHTR2AMCL1ALDH1A1KDM4E
SCHEMBL4504655 0.87 MCL1 (0.45) HTR2AMCL1ALDH1A1KDM4ESMN1; SMN2

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-20090275555-A1 Substituted indole ligands for the ORL-1 receptor BRANE DISCOVERY S.R.L. (IT) 2009-11-05 US claimed
US-20090275555-A1 Substituted indole ligands for the ORL-1 receptor BRANE DISCOVERY S.R.L. (IT) 2009-11-05 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-20090275555-A1 Substituted indole ligands for the ORL-1 receptor OGFRL1, OPRL1, ORMDL3 LMNA 4213/4885HTR2A 126/4885MCL1 1303/4885

“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.