SCHEMBL785723

SCHEMBL785723

O=C(O)c1ccc2c(c1)CCC2N1Cc2cccc(Cl)c2C1=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 2/20 0.42
MAPT P10636 1/20 0.41
AKR1C3 P42330 3/20 0.38
AKR1C2 P52895 2/20 0.38
AKR1C1 Q04828 1/20 0.38
HTR2A P28223 2/20 0.37
HTR2C P28335 2/20 0.37
HTR2B P41595 2/20 0.37
PARP1 P09874 2/20 0.37
POLB P06746 1/20 0.37
HTT P42858 1/20 0.37
ESR2 Q92731 1/20 0.37
GCGR P47871 1/20 0.36
RORC P51449 1/20 0.36
ALDH1A1 P00352 2/20 0.36
SRD5A1 P18405 1/20 0.36
SRD5A2 P31213 1/20 0.36
PARP2 Q9UGN5 1/20 0.35

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
SCHEMBL2816152 1.00 CRBN (0.42) CRBNMAPTAKR1C3AKR1C2AKR1C1
SCHEMBL785795 1.00 CRBN (0.42) CRBNMAPTAKR1C3AKR1C2AKR1C1
SCHEMBL484302 0.92 CRBN (0.42) CRBNMAPTAKR1C3AKR1C2AKR1C1
SCHEMBL785044 0.92 CRBN (0.42) CRBNMAPTAKR1C3AKR1C2AKR1C1
SCHEMBL2820739 0.87 MAPT (0.40) CRBNMAPTPOLBALDH1A1
SCHEMBL803744 0.87 MAPT (0.40) CRBNMAPTPOLBALDH1A1
SCHEMBL2816793 0.87 MAPT (0.40) CRBNMAPTPOLBALDH1A1
SCHEMBL484776 0.86 MAPT (0.41) CRBNMAPTAKR1C3AKR1C2AKR1C1
SCHEMBL785475 0.86 MAPT (0.41) CRBNMAPTAKR1C3AKR1C2AKR1C1
SCHEMBL2822029 0.86 MAPT (0.41) CRBNMAPTAKR1C3AKR1C2AKR1C1

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-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 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-20120071461-A1 Substituted Benzamide Compounds BDKRB1, BDKRB2, HRH2 CRBN 3728/4885MAPT 3149/4885AKR1C3 536/4885

“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.