SCHEMBL20007190

SCHEMBL20007190

CN(C(=O)c1cc(B2OC(C)(C)C(C)(C)O2)cc(C(=O)N(C)c2ccc(-c3ccccc3)nc2)c1)c1ccc(-c2ccccc2)nc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OXTR P30559 2/20 0.44
DGAT1 O75907 1/20 0.43
PDGFRB P09619 1/20 0.40
KDR P35968 1/20 0.40
LIPG Q9Y5X9 2/20 0.39
LPL P06858 1/20 0.39
ATM Q13315 1/20 0.39
LDHA P00338 1/20 0.39
BAZ2B Q9UIF8 1/20 0.38
EGFR P00533 1/20 0.37
PRKCA P17252 1/20 0.37
P4HB P07237 1/20 0.36
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
ALOX15 P16050 1/20 0.35
AVPR1A P37288 1/20 0.35
MLNR O43193 2/20 0.35
KDM4E B2RXH2 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL19933604 0.87 LDHA (0.44) OXTRDGAT1PDGFRBKDRLIPG
SCHEMBL19933614 0.85 ABL1 (0.41) OXTRDGAT1PDGFRBKDRLIPG
SCHEMBL18573165 0.85 OXTR (0.56) OXTRATMLDHABAZ2BEGFR
SCHEMBL19933593 0.79 OXTR (0.51) OXTRATMLDHABAZ2BEGFR
SCHEMBL22059448 0.79 OXTR (0.51) OXTRATMLDHABAZ2BEGFR
SCHEMBL21125091 0.78 OXTR (0.52) OXTRATMLDHABAZ2BEGFR
SCHEMBL20007197 0.77 DGAT1 (0.52) DGAT1PDGFRBKDRLIPGLPL
SCHEMBL19933597 0.77 ABL1 (0.43) OXTRPDGFRBKDRRAB9AKDM4E
SCHEMBL19933738 0.77 OXTR (0.51) OXTRATMLDHABAZ2BEGFR
SCHEMBL22290747 0.76 KDM1A (0.47) LIPGLPLATMEGFRP4HB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11136343-B2 Binuclear metal complexes for use as emitters in organic electroluminescent devices MERCK PATENT GMBH (DE) 2021-10-05 US disclosed
EP-3507294-B1 BINUCLEAR AND TRINUCLEAR METAL COMPLEXES COMPOSED OF TWO INTER-LINKED TRIPODAL HEXADENTATE LIGANDS FOR USE IN ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-02-24 EP disclosed
US-10889604-B2 Binuclear and trinuclear metal complexes composed of two inter-linked tripodal hexadentate ligands for use in electroluminescent devices MERCK PATENT GMBH 2021-01-12 US disclosed
EP-3515925-B1 BINUCLEAR METAL COMPLEXES FOR USE AS EMITTERS IN ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-10-21 EP disclosed
US-20200052213-A1 BINUCLEAR METAL COMPLEXES AND ELECTRONIC DEVICES, IN PARTICULAR ORGANIC ELECTROLUMINESCENT DEVICES CONTAINING SAID METAL COMPLEXES MERCK PATENT GMBH (DE) 2020-02-13 US disclosed
US-20190292210-A1 BINUCLEAR METAL COMPLEXES FOR USE AS EMITTERS IN ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-09-26 US disclosed
US-20190202851-A1 BINUCLEAR AND TRINUCLEAR METAL COMPLEXES COMPOSED OF TWO INTER-LINKED TRIPODAL HEXADENTATE LIGANDS FOR USE IN ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-07-04 US disclosed
WO-2018054798-A1 BINUCLEAR METAL COMPLEXES FOR USE AS EMITTERS IN ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2018-03-29 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 (5 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-20190202851-A1 BINUCLEAR AND TRINUCLEAR METAL COMPLEXES COMPOSED OF TWO INTER-LINKED TRIPODAL HEXADENTATE LIGANDS FOR USE IN ELECTROLUMINESCENT DEVICES PARN, PUF60, PARG OXTR 1526/4885DGAT1 2586/4885PDGFRB 3897/4885
US-20190292210-A1 BINUCLEAR METAL COMPLEXES FOR USE AS EMITTERS IN ORGANIC ELECTROLUMINESCENT DEVICES AP2M1, MCU, AP3M1 OXTR 1165/4885DGAT1 1147/4885PDGFRB 4734/4885
US-10889604-B2 Binuclear and trinuclear metal complexes composed of two inter-linked tripodal hexadentate ligands for use in electroluminescent devices PARN, PUF60, PARG OXTR 1526/4885DGAT1 2586/4885PDGFRB 3897/4885
US-11136343-B2 Binuclear metal complexes for use as emitters in organic electroluminescent devices AP2M1, MCU, AP3M1 OXTR 1165/4885DGAT1 1147/4885PDGFRB 4734/4885
US-20200052213-A1 BINUCLEAR METAL COMPLEXES AND ELECTRONIC DEVICES, IN PARTICULAR ORGANIC ELECTROLUMINESCENT DEVICES CONTAINING SAID METAL COMPLEXES BICRA, NCLN, IMMT OXTR 1806/4885DGAT1 1932/4885PDGFRB 4858/4885

“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.