SCHEMBL1623970

SCHEMBL1623970

O=C1Nc2ccc(Cl)cc2C(c2ccc(O)cc2)NC1c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.46
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
TRPM5 Q9NZQ8 3/20 0.43
TRPM4 Q8TD43 2/20 0.43
GAA P10253 1/20 0.41
TP53 P04637 4/20 0.40
MAPT P10636 3/20 0.40
LMNA P02545 1/20 0.39
ALB P02768 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
CASP1 P29466 1/20 0.39
CYP2C19 P33261 1/20 0.39
RECQL P46063 1/20 0.39
SLC8B1 Q6J4K2 1/20 0.39
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39

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
SCHEMBL1687514 0.85 MDM2 (0.41) TP53MDM2
SCHEMBL13981271 0.83 ATM (0.48) ATMMEN1KMT2ATRPM5TRPM4
SCHEMBL1623976 0.75 TRPM5 (0.41) ATMMEN1KMT2ATRPM5TRPM4
SCHEMBL7463659 0.74 BRD4 (0.51) ATMMEN1KMT2AGAATP53
SCHEMBL1421019 0.72 ATM (0.53) ATMMEN1KMT2ATRPM5TRPM4
SCHEMBL12223026 0.71 CYP26A1 (0.40) ATMMEN1KMT2ATP53MAPT
SCHEMBL9526098 0.69 CCKBR (0.53) MEN1KMT2A
SCHEMBL9526645 0.69 CCKBR (0.53) MEN1KMT2A
SCHEMBL13981274 0.69 TSHR (0.52) ATMMEN1KMT2ATRPM5TP53
SCHEMBL8923872 0.69 ATM (0.45) ATMMEN1KMT2AGAATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088757-A1 NOVEL 1,4-BENZODIAZEPINE-2,5-DIONES WITH THERAPEUTIC PROPERTIES THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-04-12 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-20120088757-A1 NOVEL 1,4-BENZODIAZEPINE-2,5-DIONES WITH THERAPEUTIC PROPERTIES BAD, GABRA5, GABRB1 ATM 3151/4885MEN1 3905/4885KMT2A 2915/4885

“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.