SCHEMBL16553034

SCHEMBL16553034

CC(C)(C)c1ccccc1-c1cc(-c2ccccc2)ncn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MIF P14174 1/20 0.47
▸ ASIC3 Q9UHC3 1/20 0.47
▸ CYP1A2 P05177 8/20 0.47
▸ CYP3A4 P08684 4/20 0.47
▸ KMO O15229 2/20 0.46
▸ KMT2A Q03164 3/20 0.43
▸ CYP2C19 P33261 8/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ TSHR P16473 6/20 0.42
▸ CYP2D6 P10635 4/20 0.42
▸ HIF1A Q16665 2/20 0.42
▸ HRH4 Q9H3N8 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ RECQL P46063 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ ALOX15 P16050 2/20 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
SCHEMBL27405557 0.84 CYP1A2 (0.43) MIFASIC3CYP1A2CYP3A4KMO
SCHEMBL21003370 0.78 ASIC3 (0.57) MIFASIC3CYP1A2CYP3A4KMO
SCHEMBL284286 0.78 ASIC3 (0.71) MIFASIC3CYP1A2KMOKMT2A
SCHEMBL25517788 0.76 MIF (0.50) MIFASIC3CYP1A2KMOKMT2A
SCHEMBL27904874 0.75 ASIC3 (0.68) MIFASIC3CYP1A2KMOKMT2A
SCHEMBL28218682 0.75 ASIC3 (0.68) MIFASIC3CYP1A2KMOKMT2A
SCHEMBL29406194 0.75 ASIC3 (0.68) MIFASIC3CYP1A2KMOKMT2A
SCHEMBL2129121 0.75 ASIC3 (0.53) MIFASIC3CYP1A2KMOKMT2A
SCHEMBL15458860 0.74 LIMK1 (0.39) MIFASIC3CYP1A2CYP3A4KMO
SCHEMBL31121692 0.74 MIF (0.50) MIFASIC3CYP1A2CYP3A4KMO

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-20160343959-A1 Organometallic Iridium Complex, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-11-24 — — US disclosed
US-20160343959-A1 Organometallic Iridium Complex, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-11-24 — — US disclosed
US-20160343959-A1 Organometallic Iridium Complex, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-11-24 — — US disclosed
US-9412956-B2 Organometallic iridium complex, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-08-09 — — US disclosed
US-9412956-B2 Organometallic iridium complex, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-08-09 — — US disclosed
US-9412956-B2 Organometallic iridium complex, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-08-09 — — US disclosed
WO-2015037548-A1 ORGANOMETALLIC IRIDIUM COMPLEX, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-03-19 — — WO disclosed
US-20150073142-A1 Organometallic Iridium Complex, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2015-03-12 — — US disclosed
US-20150073142-A1 Organometallic Iridium Complex, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2015-03-12 — — US disclosed
US-20150073142-A1 Organometallic Iridium Complex, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2015-03-12 — — 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-20160343959-A1 Organometallic Iridium Complex, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device RAD1, INTS6, CRY1 MIF 3110/4885ASIC3 3309/4885CYP1A2 274/4885

“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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