SCHEMBL13412947

SCHEMBL13412947

CCCCN1CCN(C(C)CC(C)C)CC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 2/20 0.40
GNAO1 P09471 2/20 0.40
GNAI1 P63096 2/20 0.40
DRD3 P35462 3/20 0.37
DRD2 P14416 2/20 0.37
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
USP2 O75604 1/20 0.34
KDM1A O60341 1/20 0.34

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
SCHEMBL13412948 0.88 DRD2 (0.36) DRD3DRD2SIGMAR1OPRD1
SCHEMBL19634914 0.82 GNAI3 (0.41) GNAI3GNAO1GNAI1DRD3DRD2
SCHEMBL13412945 0.79 KDM4E (0.34) SMN1; SMN2
SCHEMBL10175178 0.79 MAOB (0.47) GNAI3GNAO1GNAI1DRD3DRD2
SCHEMBL18536496 0.78
SCHEMBL5475889 0.78 ALOX15 (0.52) SIGMAR1
SCHEMBL7991668 0.77 GNAI3 (0.48) GNAI3GNAO1GNAI1DRD3SIGMAR1
SCHEMBL19630044 0.77 GNAI3 (0.48) GNAI3GNAO1GNAI1DRD3SIGMAR1
SCHEMBL4396763 0.76 GNAI3 (0.42) GNAI3GNAO1GNAI1DRD3DRD2
SCHEMBL6806026 0.76 GNAI3 (0.42) GNAI3GNAO1GNAI1DRD3DRD2

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-20100055183-A1 TRIMEPRAZINE AND ETHOPROPAZINE DERIVATIVES FOR PROMOTING BONE GROWTH OSTEOGENEX INC. (US) 2010-03-04 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-20100055183-A1 TRIMEPRAZINE AND ETHOPROPAZINE DERIVATIVES FOR PROMOTING BONE GROWTH IGFBP5, BMP2, HGF GNAI3 3072/4885GNAO1 3528/4885GNAI1 2932/4885

“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.