SCHEMBL20059752

SCHEMBL20059752

Cc1cc(C(=O)N2CCCC[C@@H]2C=O)c(N)cc1C(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PREP P48147 1/20 0.41
FFAR1 O14842 1/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 2/20 0.38
HSD11B1 P28845 2/20 0.38
HCRTR1 O43613 2/20 0.37
HCRTR2 O43614 2/20 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
SCHEMBL23714141 0.84 CNR2 (0.41) HPGD
SCHEMBL8633260 0.78 PREP (0.54) PREPFFAR1HCRTR1HCRTR2
SCHEMBL5173202 0.73 PREP (0.51) PREPHPGD
SCHEMBL7284818 0.73 PREP (0.51) PREPHPGD
SCHEMBL11447174 0.73 PREP (0.51) PREPHPGD
SCHEMBL17009656 0.68 MAPT (0.57) HPGD
SCHEMBL11117347 0.68 MAPT (0.60)
SCHEMBL4400929 0.68 AKR1C3 (0.57) HPGD
SCHEMBL23714138 0.66 KMT2A (0.39) PREPTP53HPGDHCRTR1HCRTR2
SCHEMBL8033801 0.66 MAPT (0.72)

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-20210238301-A1 NOVEL BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2021-08-05 US disclosed
EP-3100745-B1 NOVEL BENZODIAZEPINE DERIVATIVES IMMUNOGEN INC (US) 2018-04-18 EP 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-20210238301-A1 NOVEL BENZODIAZEPINE DERIVATIVES GABRB1, GABRB3, GABRA1 PREP 3423/4885FFAR1 1133/4885TP53 2553/4885

“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.