SCHEMBL6134957

SCHEMBL6134957

COCCCCCCN1CCC(Oc2ccc(N3CCN(c4ccc(-c5ccc(C(=O)OC)cc5)cc4)CC3)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.47
CTSB P07858 2/20 0.47
CTSS P25774 2/20 0.47
DRD3 P35462 1/20 0.47
POLB P06746 1/20 0.46
HRH3 Q9Y5N1 7/20 0.45
ACACB O00763 2/20 0.44
LMNA P02545 1/20 0.44
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HTT P42858 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
SCHEMBL6134380 0.91 HRH1 (0.49) CTSLCTSBCTSSDRD3HRH3
SCHEMBL6135261 0.91 KMT2A (0.50) CTSLCTSBCTSSHRH3LMNA
SCHEMBL6133614 0.88 DRD3 (0.52) DRD3POLBHRH3MEN1KMT2A
SCHEMBL6135365 0.87 OPRM1 (0.49) CTSLCTSBCTSSHRH3LMNA
SCHEMBL6135024 0.85 CTSL (0.46) CTSLCTSBCTSSHRH3LMNA
SCHEMBL6134783 0.83 HDAC3 (0.49) CTSLCTSBCTSSDRD3HRH3
SCHEMBL6134473 0.81 OPRM1 (0.52) CTSLCTSBCTSSHRH3LMNA
SCHEMBL6135617 0.80 MAPT (0.51) DRD3POLBHRH3ALDH1A1HTT
SCHEMBL6134614 0.78 DRD3 (0.47) DRD3POLBHRH3ALDH1A1HTT
SCHEMBL6134389 0.78 DRD3 (0.51) DRD3HRH3MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050261177-A1 Compound ASTELLAS PHARMA INC. (JP) 2005-11-24 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-20050261177-A1 Compound MANBA, MAN2B1, MAN2A1 CTSL 222/4885CTSB 1244/4885CTSS 491/4885

“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.