SCHEMBL17870867

SCHEMBL17870867

Nc1ccccc1N1c2ccccc2-c2ccccc2-c2cccc(Cl)c21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
KDM4E B2RXH2 3/20 0.40
GAA P10253 2/20 0.40
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
MAPK14 Q16539 4/20 0.36
ALDH1A1 P00352 3/20 0.36
NR4A2 P43354 1/20 0.36
LMNA P02545 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
USP2 O75604 1/20 0.34
TP53 P04637 1/20 0.34
HTT P42858 1/20 0.34
CYP3A4 P08684 1/20 0.34
NFKB1 P19838 1/20 0.34
PMP22 Q01453 1/20 0.34
MGLL Q99685 1/20 0.33
KEAP1 Q14145 1/20 0.33
MAPK11 Q15759 1/20 0.33
HSPA1A P0DMV8 1/20 0.33

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
SCHEMBL17882362 0.80 DPP4 (0.47) TSHRKDM4EGAAMEN1KMT2A
SCHEMBL21941983 0.80 DPP4 (0.36) TSHRKDM4EMEN1KMT2AMAPK14
SCHEMBL21942500 0.80 GAA (0.48) KDM4EGAAMEN1KMT2AALDH1A1
SCHEMBL21941975 0.79 KDM4E (0.31) KDM4EMAPK14ALDH1A1L3MBTL1CYP3A4
SCHEMBL13314104 0.75 CES1 (0.39) TSHRKDM4EGAAMEN1KMT2A
SCHEMBL13941868 0.75 MEN1 (0.38) TSHRGAAMEN1KMT2AMAPK14
SCHEMBL17882411 0.74 ALDH1A1 (0.43) GAAMEN1KMT2AALDH1A1LMNA
SCHEMBL30596240 0.66 CES1 (0.58) TSHRGAAMEN1KMT2AMAPK14
SCHEMBL11409331 0.66 CES1 (0.58) TSHRGAAMEN1KMT2AMAPK14
SCHEMBL30596238 0.66 CES1 (0.58) TSHRGAAMEN1KMT2AMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3237387-B1 HETEROCYCLIC COMPOUNDS WITH DIBENZAZAPINE STRCTURES MERCK PATENT GMBH (DE) 2023-09-06 EP disclosed
US-10636979-B2 Heterocyclic compounds with dibenzazapine structures MERCK PATENT GMBH (DE) 2020-04-28 US disclosed
EP-3237387-A1 HETEROCYCLIC COMPOUNDS WITH DIBENZAZAPINE STRCTURES Merck Patent GmbH (DE) 2017-11-01 EP disclosed
WO-2016102039-A1 HETEROCYCLIC COMPOUNDS WITH DIBENZAZAPINE STRCTURES MERCK PATENT GMBH (DE) 2016-06-30 WO disclosed
WO-2016102039-A1 HETEROCYCLIC COMPOUNDS WITH DIBENZAZAPINE STRCTURES MERCK PATENT GMBH (DE) 2016-06-30 WO 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-10636979-B2 Heterocyclic compounds with dibenzazapine structures DDT, MAOA, MAOB TSHR 2917/4885KDM4E 1175/4885GAA 1138/4885

“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.