SCHEMBL430148

SCHEMBL430148

c1cc(-c2ccccc2-c2ccccc2-c2cccc3c2sc2ccccc23)cc(-c2cccc3c2sc2ccccc23)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.65
PARP14 Q460N5 1/20 0.49
PRKDC P78527 6/20 0.44
GPR3 P46089 1/20 0.43
TNKS O95271 1/20 0.42
TNKS2 Q9H2K2 1/20 0.42
PIK3CD O00329 2/20 0.41
PIK3CB P42338 2/20 0.41
BRD4 O60885 1/20 0.41
PIK3CA P42336 1/20 0.41
MTOR P42345 1/20 0.41
PIK3CG P48736 1/20 0.41
KCNH2 Q12809 1/20 0.41
BRDT Q58F21 1/20 0.41
F9 P00740 1/20 0.39
MAPT P10636 3/20 0.38
LIMK1 P53667 2/20 0.37
RAB9A P51151 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL429390 0.98 ALOX5 (0.67) ALOX5PARP14PRKDCGPR3TNKS
SCHEMBL31422436 0.95 ALOX5 (0.63) ALOX5PARP14PRKDCGPR3TNKS
SCHEMBL12996531 0.95 ALOX5 (0.71) ALOX5PARP14PRKDCGPR3TNKS
SCHEMBL17827359 0.93 ALOX5 (0.69) ALOX5PARP14PRKDCGPR3TNKS
SCHEMBL29511967 0.93 ALOX5 (0.69) ALOX5PARP14PRKDCGPR3TNKS
SCHEMBL1687975 0.93 ALOX5 (0.69) ALOX5PARP14PRKDCGPR3TNKS
SCHEMBL12996536 0.90 ALOX5 (0.65) ALOX5PARP14PRKDCGPR3TNKS
SCHEMBL29892311 0.90 ALOX5 (0.65) ALOX5PARP14PRKDCGPR3TNKS
SCHEMBL25680432 0.90 ALOX5 (0.65) ALOX5PARP14PRKDCGPR3TNKS
SCHEMBL29072912 0.89 ALOX5 (0.55) ALOX5PARP14PRKDCGPR3TNKS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9406893-B2 Heterocyclic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-08-02 US disclosed
US-9406893-B2 Heterocyclic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-08-02 US disclosed
US-20140299861-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2014-10-09 US disclosed
US-20140299861-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2014-10-09 US disclosed
US-8790794-B2 Heterocyclic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-07-29 US disclosed
US-8790794-B2 Heterocyclic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-07-29 US disclosed
US-20120061651-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-03-15 US disclosed
US-20120061651-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-03-15 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-20120061651-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device CYP2J2, CYP1A1, CRY1 ALOX5 2991/4885PARP14 4157/4885PRKDC 4868/4885

“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.