SCHEMBL932867

SCHEMBL932867

CSSCC(C)CN1CCN(C(=O)O)CC1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.42
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 3/20 0.33
DRD2 P14416 1/20 0.31
DRD3 P35462 1/20 0.31
USP2 O75604 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL4325910 0.75 PIK3CD (0.70) PIK3CDKDM4EALDH1A1
SCHEMBL26655296 0.73 PIK3CD (0.52) PIK3CDKDM4EALDH1A1DRD2DRD3
SCHEMBL26655290 0.73 PIK3CD (0.52) PIK3CDKDM4EALDH1A1DRD2DRD3
SCHEMBL932266 0.73 SMN1; SMN2 (0.40)
SCHEMBL26655221 0.72 PIK3CD (0.50) PIK3CDKDM4EALDH1A1DRD2DRD3
SCHEMBL26655215 0.72 PIK3CD (0.50) PIK3CDKDM4EALDH1A1DRD2DRD3
Hydrochloric Acid SCHEMBL12080214 0.71 SMN1; SMN2 (0.42)
SCHEMBL15140812 0.69 PIK3CD (0.45) PIK3CDKDM4EALDH1A1USP2ALOX15
SCHEMBL19209544 0.68 PIK3CD (0.35) PIK3CDKDM4EALDH1A1
SCHEMBL932864 0.67 PIK3CD (0.33) PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8952147-B2 Conjugates, preparation thereof, and therapeutic use thereof SANOFI (FR) 2015-02-10 US disclosed
US-20120225089-A1 NOVEL CONJUGATES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-09-06 US disclosed
EP-2448929-A1 NOVEL CONJUGATES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-05-09 EP disclosed
WO-2011001052-A1 NOVEL CONJUGATES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-01-06 WO 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-20120225089-A1 NOVEL CONJUGATES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF ERG28, CARS1, FOLH1 PIK3CD 3545/4885KDM4E 4517/4885ALDH1A1 1912/4885

“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.