SCHEMBL12092359

SCHEMBL12092359

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

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.36
▸ TACR1 P25103 1/20 0.35
▸ TP53 P04637 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ ATM Q13315 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
SCHEMBL12092350 0.79 HSD11B1 (0.45) HSD11B1TACR1TP53ALDH1A1KDM4E
SCHEMBL12092228 0.75 HSD11B1 (0.42) HSD11B1TACR1TP53ALDH1A1KDM4E
SCHEMBL16938120 0.75 HSD11B1 (0.42) HSD11B1TACR1TP53ALDH1A1KDM4E
SCHEMBL14595357 0.75 HSD11B1 (0.41) HSD11B1TACR1ALDH1A1KDM4EMEN1
SCHEMBL12092254 0.73 TACR1 (0.33) HSD11B1TACR1
SCHEMBL21015511 0.73 ATM (0.42) HSD11B1TACR1ALDH1A1KDM4EMEN1
SCHEMBL23471042 0.73 HSD11B1 (0.45) HSD11B1TACR1ALDH1A1KDM4EMEN1
SCHEMBL21015512 0.72 L3MBTL1 (0.43) HSD11B1TACR1ALDH1A1KDM4EMEN1
SCHEMBL12092346 0.71 HSD11B1 (0.41) HSD11B1TACR1ALDH1A1KDM4EMEN1
SCHEMBL21016046 0.71 GNAI3 (0.44) HSD11B1TACR1MEN1LMNAKMT2A

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 2 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

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 HSD11B1 2091/4885TACR1 2508/4885TP53 2509/4885

“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.

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