SCHEMBL16330516

SCHEMBL16330516

CCN1CCN(C(=O)CCC(C)(C)SCC(=O)ON2C(=O)CCC2=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 5/20 0.41
▸ ALDH1A1 P00352 2/20 0.38
▸ KMT2A Q03164 3/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ RXFP1 Q9HBX9 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ MDM2 Q00987 1/20 0.33
▸ GAA P10253 2/20 0.32
▸ TSHR P16473 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL12092254 0.90 TACR1 (0.33) HSD11B1
SCHEMBL16330576 0.84 HSD11B1 (0.37) HSD11B1ALDH1A1KMT2AMEN1RAB9A
SCHEMBL16330528 0.83 ALDH1A1 (0.34) HSD11B1ALDH1A1KDM4EHPGDHTT
SCHEMBL16330553 0.79 HSD11B1 (0.50) HSD11B1ALDH1A1KMT2AMEN1RAB9A
SCHEMBL12092240 0.75 TACR1 (0.30) —
SCHEMBL12092239 0.75 HPGD (0.30) HPGDHTT
SCHEMBL12092238 0.73 TACR1 (0.36) HSD11B1ALDH1A1KMT2AMEN1KDM4E
SCHEMBL16330527 0.72 ALDH1A1 (0.39) ALDH1A1LMNAGAATSHR
SCHEMBL20750016 0.72 KMT2A (0.41) HSD11B1ALDH1A1KMT2AMEN1KDM4E
SCHEMBL29523817 0.70 — —

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 2091/4885ALDH1A1 1912/4885KMT2A 3995/4885

“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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