SCHEMBL15840203

SCHEMBL15840203

c1ccc(-c2ccc3c(c2)C2(c4cc(-c5ccccc5)ccc4-3)c3ccccc3-c3c2ccc2c3[nH]c3ccccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.39
MAOA P21397 1/20 0.38
TDO2 P48775 4/20 0.37
HTR2B P41595 2/20 0.37
HTR5A P47898 2/20 0.37
KIF11 P52732 3/20 0.36
PGR P06401 1/20 0.36
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 1/20 0.35
GABRB2 P47870 1/20 0.35
GABRA4 P48169 1/20 0.35
GABRE P78334 1/20 0.35
GABRA6 Q16445 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
SCHEMBL15840202 1.00 PDK2 (0.39) PDK2MAOATDO2HTR2BHTR5A
SCHEMBL18156839 0.91 TDO2 (0.36) PDK2MAOATDO2HTR2BHTR5A
SCHEMBL15840120 0.89 PDK2 (0.36) PDK2GABRA1GABRG2GABRB3GABRA5
SCHEMBL15824466 0.88 KIF11 (0.45) MAOATDO2KIF11PGRGABRP
SCHEMBL31632211 0.88 KIF11 (0.45) MAOATDO2KIF11PGRGABRP
SCHEMBL29506370 0.88 KIF11 (0.45) MAOATDO2KIF11PGRGABRP
SCHEMBL20199544 0.87 KIF11 (0.44) MAOATDO2KIF11PGRGABRP
SCHEMBL15840146 0.87 KIF11 (0.46) MAOATDO2KIF11PGRGABRP
SCHEMBL17379810 0.86 PIM3 (0.33) PDK2MAOAKIF11PGRGABRP
SCHEMBL15840241 0.83 KIF11 (0.50) MAOAKIF11PGRGABRPGABRD

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
US-10227528-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2019-03-12 US disclosed
EP-2935276-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-11-01 EP disclosed
US-20150337197-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-11-26 US disclosed
US-20150337197-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-11-26 US disclosed
WO-2014094963-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2014-06-26 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 (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-10227528-B2 Materials for organic electroluminescent devices OR10J3, EPCAM, L1CAM PDK2 1078/4885MAOA 399/4885TDO2 1798/4885
US-20150337197-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, EML4, L1CAM PDK2 1107/4885MAOA 320/4885TDO2 1478/4885

“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.