SCHEMBL19167331

SCHEMBL19167331

OC1(c2ccccc2-c2ccc(Cl)cc2)c2ccccc2-c2ccccc2-c2ccc(Br)cc21

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 15/20 0.49
MDM2 Q00987 1/20 0.38
PTPRC P08575 1/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
MCL1 Q07820 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL19167901 1.00 PDK2 (0.49) PDK2MDM2PTPRCLMNAMAPT
SCHEMBL19167898 0.91 PDK2 (0.46) PDK2MDM2PTPRCLMNAMAPT
SCHEMBL19164437 0.88 PDK2 (0.54) PDK2PTPRCHTT
SCHEMBL19164438 0.88 PDK2 (0.54) PDK2PTPRCHTT
SCHEMBL1978583 0.86 PDK2 (0.55) PDK2PTPRCHTT
SCHEMBL30463510 0.86 PDK2 (0.55) PDK2PTPRCHTT
SCHEMBL824160 0.86 PDK2 (0.55) PDK2PTPRCHTT
SCHEMBL19167894 0.86 PDK2 (0.51) PDK2MDM2
SCHEMBL19168761 0.86 PDK2 (0.50) PDK2PTPRCKMT2A
SCHEMBL24730387 0.82 PDK2 (0.51) PDK2PTPRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10431751-B2 Compound and organic electronic device comprising the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2019-10-01 US disclosed
US-20170213970-A1 Novel compound and organic electronic device comprising the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2017-07-27 US disclosed
US-20170213970-A1 Novel compound and organic electronic device comprising the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2017-07-27 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 (2 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-10431751-B2 Compound and organic electronic device comprising the same CHRM1, CHRM2, ESR1 PDK2 2514/4885MDM2 657/4885PTPRC 4578/4885
US-20170213970-A1 Novel compound and organic electronic device comprising the same CHRM1, CHRM2, ESR1 PDK2 2806/4885MDM2 715/4885PTPRC 4726/4885

“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.