SCHEMBL3625522

SCHEMBL3625522

CC(C)(C)CN1CCN(C(=O)O)CC1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.35
HSD11B1 P28845 4/20 0.35
ALDH1A1 P00352 2/20 0.34
TACR1 P25103 1/20 0.34
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL2533167 0.85 PIK3CD (0.34) PIK3CDHSD11B1ALDH1A1KMT2AKDM4E
SCHEMBL27648357 0.83 HSD11B1 (0.33) PIK3CDHSD11B1ALDH1A1KMT2AKDM4E
SCHEMBL9917292 0.83 PIK3CD (0.53) PIK3CDALDH1A1KMT2AKDM4EMEN1
SCHEMBL21551654 0.82 HSD11B1 (0.33) PIK3CDHSD11B1ALDH1A1KMT2AKDM4E
SCHEMBL23594266 0.81 KMT2A (0.41) PIK3CDHSD11B1ALDH1A1TACR1KMT2A
SCHEMBL4312389 0.79 SIGMAR1 (0.39) HSD11B1ALDH1A1KMT2AMEN1SIGMAR1
SCHEMBL22007125 0.79 FASN (0.41) PIK3CDHSD11B1ALDH1A1TACR1KMT2A
SCHEMBL17943670 0.79 ALDH1A1 (0.39) HSD11B1ALDH1A1TACR1KMT2AKDM4E
SCHEMBL10254140 0.79 BLM (0.43) HSD11B1ALDH1A1TACR1KMT2AMEN1
SCHEMBL13338120 0.79 GAA (0.55) ALDH1A1TACR1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2256119-A1 Vasopressin V1a antagonists Vantia Limited (GB) 2010-12-01 EP claimed
US-20090029965-A1 Vasopressin V1a Antagonists FERRING B.V. (NL) 2009-01-29 US claimed
EP-1781661-A2 VASOPRESSIN V1A ANTAGONISTS Ferring B.V. (NL) 2007-05-09 EP claimed
EP-1632494-A1 Vasopressin v1a antagonists FERRING B.V. (NL) 2006-03-08 EP claimed
WO-2006021213-A2 VASOPRESSIN V1A ANTAGONISTS FERRING B.V. (NL) 2006-03-02 WO claimed

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-20090029965-A1 Vasopressin V1a Antagonists AVPR1A, AVPR2, AVPR1B PIK3CD 2747/4885HSD11B1 888/4885ALDH1A1 902/4885

“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.