SCHEMBL10042625

SCHEMBL10042625

CCOP(=O)(OCC)c1ccc2c(c1)C(C)(C)c1cc(Br)ccc1-2

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.35
▸ HTR2A P28223 1/20 0.35
▸ HTR2B P41595 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ KMT2A Q03164 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ POLB P06746 1/20 0.32
▸ TDP2 O95551 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ CCNT1 O60563 2/20 0.31
▸ CDK9 P50750 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ ALK Q9UM73 2/20 0.31
▸ HDAC1 Q13547 1/20 0.30
▸ PDK2 Q15119 1/20 0.30

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
SCHEMBL30592714 0.81 TDP2 (0.37) KMT2AMEN1TDP2LMNAPDK2
SCHEMBL26626377 0.81 PDK2 (0.35) KMT2AMEN1TDP2LMNAPDK2
SCHEMBL29061576 0.81 TDP2 (0.37) KMT2AMEN1TDP2LMNAPDK2
SCHEMBL13242789 0.78 CCNT1 (0.33) NPSR1GAAKMT2AMEN1POLB
SCHEMBL3364776 0.75 GAA (0.47) NPSR1HTR2AHTR2BGAATDP1
SCHEMBL204806 0.74 PDK2 (0.44) HTR2BTDP2PDK2
SCHEMBL29587737 0.74 PDK2 (0.44) HTR2BTDP2PDK2
SCHEMBL29403081 0.74 PDK2 (0.44) HTR2BTDP2PDK2
SCHEMBL4423591 0.72 NPSR1 (0.47) NPSR1HTR2AHTR2BGAAKMT2A
SCHEMBL30592713 0.71 PDK2 (0.37) HTR2AHTR2BGAAKMT2AMEN1

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-8932735-B2 Aromatic amine derivative and organic electroluminescent element comprising the same IDEMITSU KOSAN CO., LTD. (JP) 2015-01-13 — — US disclosed
US-8932735-B2 Aromatic amine derivative and organic electroluminescent element comprising the same IDEMITSU KOSAN CO., LTD. (JP) 2015-01-13 — — US disclosed
US-20120043533-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-02-23 — — 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 (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-20120043533-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING THE SAME AOC2, AOC3, H1-4 NPSR1 1790/4885HTR2A 2221/4885HTR2B 618/4885

“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.

Send feedback