SCHEMBL5262177

SCHEMBL5262177

c1ccc(-c2[nH]c3ccccc3c2C(c2ccccc2)N2CCCC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
CNR1 P21554 6/20 0.49
CNR2 P34972 1/20 0.48
HTR2A P28223 4/20 0.47
HTR2C P28335 3/20 0.47
DRD2 P14416 1/20 0.46
LMNA P02545 1/20 0.44
KCNH2 Q12809 1/20 0.44
ABCB1 P08183 1/20 0.43
ABCC1 P33527 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.43

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
SCHEMBL20105030 0.88 HTR2A (0.56) MAPTCNR1CNR2HTR2AHTR2C
SCHEMBL20105037 0.88 HSP90AA1 (0.47) MAPTCNR1CNR2LMNAABCB1
SCHEMBL5260291 0.83 CNR1 (0.53) MAPTCNR1HTR2AHTR2CDRD2
SCHEMBL29387235 0.82 MAPT (0.72) MAPTCNR1HTR2AHTR2CLMNA
SCHEMBL5258234 0.82 CNR1 (0.52) MAPTCNR1HTR2AHTR2CDRD2
SCHEMBL5259512 0.82 CNR1 (0.52) MAPTCNR1HTR2AHTR2CDRD2
SCHEMBL5259027 0.81 CNR1 (0.55) MAPTCNR1HTR2AHTR2CDRD2
SCHEMBL20105038 0.80 CHRM2 (0.60) MAPTCNR1HTR2AHTR2CDRD2
SCHEMBL5258567 0.80 CNR1 (0.54) MAPTCNR1HTR2AHTR2CDRD2
SCHEMBL20105028 0.80 CNR1 (0.50) MAPTCNR1LMNA

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
EP-1261585-B1 SUBSTITUTED INDOLE MANNICH BASES GRUENENTHAL GMBH (DE) 2007-09-26 EP claimed
US-7091220-B2 Substituted indole Mannich bases GRUENENTHAL GMBH (DE) 2006-08-15 US claimed
EP-1261585-B1 SUBSTITUTED INDOLE MANNICH BASES GRUENENTHAL GMBH (DE) 2007-09-26 EP disclosed
EP-1261585-B1 SUBSTITUTED INDOLE MANNICH BASES GRUENENTHAL GMBH (DE) 2007-09-26 EP disclosed
US-7091220-B2 Substituted indole Mannich bases GRUENENTHAL GMBH (DE) 2006-08-15 US disclosed
US-20030060497-A1 Subtituted indole mannich bases GRUENENTHAL GMBH (DE) 2003-03-27 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-20030060497-A1 Subtituted indole mannich bases TPH1, IDO1, TPH2 MAPT 2635/4885CNR1 19/4885CNR2 20/4885

“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.