SCHEMBL880826

SCHEMBL880826

c1ccc2cc(-c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4cc5ccccc5c5ccccc45)cc3)ccc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
TUBB4A P04350 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 1/20 0.38
TUBA1B P68363 1/20 0.38
TUBA4A P68366 1/20 0.38
TUBB4B P68371 1/20 0.38
TUBB3 Q13509 1/20 0.38
TUBB2A Q13885 1/20 0.38
TUBB8 Q3ZCM7 1/20 0.38
TUBA3E Q6PEY2 1/20 0.38
TUBA1A Q71U36 1/20 0.38
TUBA1C Q9BQE3 1/20 0.38
TUBB6 Q9BUF5 1/20 0.38
TUBB2B Q9BVA1 1/20 0.38
TUBB1 Q9H4B7 1/20 0.38

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
SCHEMBL10130252 0.94 HSD17B1 (0.40) CYP1A2CYP2C9CYP2C19ESR1ESR2
SCHEMBL880829 0.94 CYP1A2 (0.47) CYP1A2CYP2C9CYP2C19ESR1ESR2
SCHEMBL10130247 0.93 CYP1A2 (0.44) CYP1A2CYP2C9CYP2C19TDP1TSPO
SCHEMBL15964341 0.93 CYP1A2 (0.41) CYP1A2CYP2C9CYP2C19ALOX5TDP1
SCHEMBL10130250 0.91 CYP1A2 (0.45) CYP1A2CYP2C9CYP2C19ESR1ESR2
SCHEMBL15479813 0.91 CYP1A2 (0.38) CYP1A2CYP2C9CYP2C19TUBB4ATUBB
SCHEMBL10130254 0.89 CYP1A2 (0.44) CYP1A2CYP2C9CYP2C19ESR1ESR2
SCHEMBL10059285 0.89 TUBB4A (0.38) CYP1A2CYP2C9CYP2C19ESR1ESR2
SCHEMBL10130243 0.89 CYP11B1 (0.38) CYP1A2CYP2C9CYP2C19ALOX5CA1
SCHEMBL20149473 0.88 CYP1A2 (0.42) CYP1A2CYP2C9CYP2C19ALOX5TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10263195-B2 Organic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2019-04-16 US disclosed
US-20190074450-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LAB (JP) 2019-03-07 US disclosed
US-10181563-B2 2019-01-15 US disclosed
US-20170162798-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LAB (JP) 2017-06-08 US disclosed
US-20170162798-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LAB (JP) 2017-06-08 US disclosed
US-9614164-B2 Organic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-04-04 US disclosed
US-9614164-B2 Organic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-04-04 US disclosed
US-20150221875-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LAB (JP) 2015-08-06 US disclosed
US-20150221875-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LAB (JP) 2015-08-06 US disclosed
US-9040720-B2 Organic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-05-26 US disclosed
US-9040720-B2 Organic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-05-26 US disclosed
US-20140066633-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-03-06 US disclosed
US-20140066633-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-03-06 US disclosed
EP-2433929-B1 Organic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LAB (JP) 2013-10-23 EP disclosed
US-20120077987-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-03-29 US disclosed
US-20120077987-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-03-29 US disclosed
EP-2433929-A1 Organic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device Semiconductor Energy Laboratory Co, Ltd. (JP) 2012-03-28 EP 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 (5 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-20170162798-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE GPR3, CCNT1, GALR3 CYP1A2 46/4885CYP2C9 151/4885CYP2C19 86/4885
US-20190074450-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE GPR3, GLB1, CCNT1 CYP1A2 53/4885CYP2C9 129/4885CYP2C19 96/4885
US-20120077987-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE GPR3, CCNT1, GALR3 CYP1A2 46/4885CYP2C9 151/4885CYP2C19 86/4885
US-10181563-B2 GLB1, B3GAT3, CCNT1 CYP1A2 22/4885CYP2C9 585/4885CYP2C19 399/4885
US-10263195-B2 Organic compound, light-emitting element, light-emitting device, electronic device, and lighting device GPR3, CCNT1, GALR3 CYP1A2 46/4885CYP2C9 151/4885CYP2C19 86/4885

“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.