SCHEMBL18174536

SCHEMBL18174536

c1ccc(C2(c3ccccc3)c3ccccc3-c3ncccc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.51
KMT2A Q03164 4/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
LMNA P02545 3/20 0.44
MEN1 O00255 3/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
OPRK1 P41145 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GAA P10253 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
PTPRC P08575 2/20 0.40
CTSL P07711 1/20 0.40
CTSS P25774 1/20 0.40
PTPN13 Q12923 1/20 0.40
TDP2 O95551 1/20 0.39
NSD2 O96028 1/20 0.39
ABL1 P00519 1/20 0.39
PLCG1 P19174 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
SCHEMBL30322608 0.86 PDK2 (0.56) PDK2KMT2ACYP1A2CYP2C19LMNA
SCHEMBL11990868 0.86 PDK2 (0.56) PDK2KMT2ACYP1A2CYP2C19LMNA
SCHEMBL19955995 0.86 PDK2 (0.49) PDK2KMT2ACYP1A2CYP2C19LMNA
SCHEMBL19886858 0.83 PDK2 (0.53) PDK2KMT2ACYP1A2CYP2C19LMNA
SCHEMBL32682807 0.80 PDK2 (0.49) PDK2KMT2ACYP1A2CYP2C19LMNA
SCHEMBL29419598 0.80 PDK2 (0.49) PDK2KMT2ACYP1A2CYP2C19LMNA
SCHEMBL5344736 0.80 PDK2 (0.49) PDK2KMT2ACYP1A2CYP2C19LMNA
SCHEMBL17701457 0.80 KMT2A (0.39) PDK2KMT2ACYP1A2CYP2C19LMNA
SCHEMBL21104282 0.80 PDK2 (0.39) PDK2KMT2ACYP1A2CYP2C19LMNA
SCHEMBL27954463 0.79 KMT2A (0.55) PDK2KMT2ACYP1A2CYP2C19LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4306613-A1 ORGANOMETALLIC COMPOUND, LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND, AND ELECTRONIC APPARATUS AND ELECTRONIC DEVICE INCLUDING THE LIGHT-EMITTING DEVICE Samsung Display Co., Ltd. (KR) 2024-01-17 EP disclosed
US-20190185457-A1 HETEROCYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE HETEROCYCLIC COMPOUND SAMSUNG ELECTRONICS CO LTD (KR) 2019-06-20 US disclosed
US-20160329509-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2016-11-10 US disclosed
US-20160329509-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2016-11-10 US disclosed
US-9478758-B1 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2016-10-25 US disclosed
US-9478758-B1 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2016-10-25 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-20190185457-A1 HETEROCYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE HETEROCYCLIC COMPOUND CRY1, NAP1L1, CYP1A1 PDK2 2435/4885KMT2A 769/4885CYP1A2 35/4885
US-20160329509-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES SOD1, SLC25A21, SLC25A11 PDK2 1107/4885KMT2A 3230/4885CYP1A2 1310/4885

“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.