SCHEMBL13429474

SCHEMBL13429474

O=c1c2ccccc2c2c3ccccc3[nH]c3c4c(=O)c5ccccc5c5c6ccccc6[nH]c(c1c32)c45

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 3/20 0.59
▸ NQO1 P15559 1/20 0.54
▸ CDK4 P11802 6/20 0.53
▸ CCND1 P24385 6/20 0.53
▸ CAMK2B Q13554 4/20 0.53
▸ CAMK2G Q13555 4/20 0.53
▸ CAMK2D Q13557 4/20 0.53
▸ CAMK2A Q9UQM7 4/20 0.53
▸ PRKCA P17252 3/20 0.53
▸ CCNE2 O96020 3/20 0.53
▸ CCNE1 P24864 3/20 0.53
▸ CDK2 P24941 3/20 0.53
▸ CDK5 Q00535 2/20 0.53
▸ CDK5R1 Q15078 2/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ PRKD3 O94806 1/20 0.53
▸ CCNB2 O95067 1/20 0.53
▸ PRKCG P05129 1/20 0.53

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
SCHEMBL4703362 0.90 CHEK1 (0.67) CHEK1NQO1CDK4CCND1CAMK2B
SCHEMBL21563828 0.84 KDM4E (0.67) CHEK1NQO1CDK4CCND1CAMK2B
SCHEMBL14431320 0.83 CDK4 (0.59) CHEK1NQO1CDK4CCND1CAMK2B
SCHEMBL14431319 0.82 CCNB2 (0.58) CHEK1NQO1CDK4CCND1CAMK2B
SCHEMBL14532081 0.82 CDK2 (0.52) CHEK1NQO1CDK4CCND1CAMK2B
SCHEMBL13772111 0.82 CDK4 (0.57) CHEK1NQO1CDK4CCND1CAMK2B
SCHEMBL23132413 0.81 CHEK1 (0.76) CHEK1CDK4CCND1CAMK2BCAMK2G
SCHEMBL2627635 0.79 CHEK1 (0.67) CHEK1CDK4CCND1CAMK2BCAMK2G
SCHEMBL12219428 0.79 CHEK1 (0.65) CHEK1CDK4CCND1CAMK2BCAMK2G
SCHEMBL29533066 0.79 CHEK1 (0.65) CHEK1CDK4CCND1CAMK2BCAMK2G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100065200-A1 Tetrabenzodiazadiketoperylene pigments in laser welding SARVER JOSEPHD E 2010-03-18 — — US disclosed
US-20100065200-A1 Tetrabenzodiazadiketoperylene pigments in laser welding SARVER JOSEPHD E 2010-03-18 — — US disclosed
EP-1973912-B1 TETRABENZODIAZADIKETOPERYLENE COLOURANTS IN IR-REFLECTIVE COATINGS AND PLASTICS CIBA HOLDING INC (CH) 2009-07-15 — — EP disclosed
US-7544448-B2 Tetrabenzodiazadiketoperylene pigments for laser marking CIBA SPECIALTY CHEMICALS CORPORATION (US) 2009-06-09 — — US disclosed
US-7544448-B2 Tetrabenzodiazadiketoperylene pigments for laser marking CIBA SPECIALTY CHEMICALS CORPORATION (US) 2009-06-09 — — US disclosed
US-20070179222-A1 Tetrabenzodiazadiketoperylene pigments and dyes CIBA SPECIALTY CHEMICALS CORP. 2007-08-02 — — US disclosed
WO-2007082811-A2 TETRABENZODIAZADIKETOPERYLENE COLOURANTS IN IR-REFLECTIVE COATINGS AND PLASTICS CIBA HOLDING INC. (CH) 2007-07-26 — — WO disclosed
WO-2007057367-A2 TETRABENZODIAZADIKETOPERYLENE PIGMENTS FOR LASER MARKING CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-05-24 — — WO disclosed
US-20070114494-A1 Tetrabenzodiazadiketoperylene pigments for laser marking CIBA SPECIALTY CHEMICALS CORP. 2007-05-24 — — US disclosed
US-20070114494-A1 Tetrabenzodiazadiketoperylene pigments for laser marking CIBA SPECIALTY CHEMICALS CORP. 2007-05-24 — — 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-20070179222-A1 Tetrabenzodiazadiketoperylene pigments and dyes TYR, DDT, PAH CHEK1 1899/4885NQO1 2419/4885CDK4 1442/4885
US-20070114494-A1 Tetrabenzodiazadiketoperylene pigments for laser marking TYR, DDT, PAH CHEK1 1575/4885NQO1 2479/4885CDK4 2485/4885

“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.

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