SCHEMBL7555403

SCHEMBL7555403

O=C(O)C[C@H]1c2cc(O)ccc2CCC(=O)N1CCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.46
GRIN1 Q05586 2/20 0.42
GRIN2B Q13224 2/20 0.42
ALDH1A1 P00352 3/20 0.40
TSHR P16473 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GRM5 P41594 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
DRD1 P21728 2/20 0.38
HTR2A P28223 1/20 0.38
OPRM1 P35372 1/20 0.38
CYP2C19 P33261 1/20 0.37

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
SCHEMBL6942400 0.70 ITGB3 (0.41) DRD3GRIN1GRIN2BGRM5SIGMAR1
SCHEMBL4843429 0.68 TRPV1 (0.36) OPRM1
SCHEMBL7397950 0.68 ALDH1A1 (0.52) ALDH1A1TSHRSMN1; SMN2
SCHEMBL6420268 0.67 ITGB3 (0.56) OPRM1
SCHEMBL6420263 0.67 ITGB3 (0.56) OPRM1
SCHEMBL3411465 0.66 ESR1 (0.62)
SCHEMBL11476415 0.66 GRIN1 (0.60) DRD3GRIN1GRIN2BGRM5SIGMAR1
SCHEMBL13738633 0.66 ESR1 (0.50) DRD3GRIN1GRIN2BSIGMAR1DRD1
SCHEMBL17951053 0.66 ALDH1A1 (0.62) ALDH1A1TSHRSMN1; SMN2SIGMAR1HTR2A
SCHEMBL19974920 0.66 ALDH1A1 (0.62) ALDH1A1TSHRSMN1; SMN2SIGMAR1HTR2A

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-20020032187-A1 Method for stimulating bone formation SMITHKLINE BEECHAM CORPORATION 2002-03-14 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-20020032187-A1 Method for stimulating bone formation BMP2, BMP4, SOST DRD3 4315/4885GRIN1 1647/4885GRIN2B 1182/4885

“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.