SCHEMBL4789264

SCHEMBL4789264

Cc1ccn(-n2cccc2)c1

nearest known ligand 0.31

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
INMT O95050 1/20 0.31
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30
ALOX12 P18054 1/20 0.30
ACHE P22303 1/20 0.30
KDM4E B2RXH2 2/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
HPGD P15428 1/20 0.30
BLM P54132 1/20 0.30
HSD17B10 Q99714 1/20 0.30
POLB P06746 1/20 0.30
APOBEC3A P31941 1/20 0.30
APOBEC3G Q9HC16 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
SCHEMBL102770 0.65 POLB (0.33) POLB
SCHEMBL9809742 0.63 INMT (0.41) CA1CA2INMTACHEKDM4E
SCHEMBL28230993 0.63 POLB (0.44) POLB
SCHEMBL28146711 0.61
SCHEMBL27932529 0.61 POLB (0.32) POLB
SCHEMBL14616122 0.60 TSHR (0.46) LMNATSHRALOX12ACHEKDM4E
P-Xylene SCHEMBL28198946 0.57 ACHE (0.50) CA1CA2INMTLMNATSHR
P-Xylene SCHEMBL3847044 0.54
Toluene SCHEMBL3849694 0.53
Toluene SCHEMBL6946264 0.53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230071734-A1 Light-Emitting Element, Lighting Device, Light-Emitting Device, And Electronic Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2023-03-09 US disclosed
US-20200251676-A1 Light-Emitting Element, Lighting Device, Light-Emitting Device, and Electronic Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2020-08-06 US disclosed
WO-2008149828-A1 ORGANOMETALLIC COMPLEX, AND LIGHT-EMITTING MATERIA LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE AND ELECTRONIC DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2008-12-11 WO disclosed
US-20080305361-A1 Organometallic Complex, and Light-Emitting Material, Light-Emitting Element, Light-Emitting Device and Electronic Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2008-12-11 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-20080305361-A1 Organometallic Complex, and Light-Emitting Material, Light-Emitting Element, Light-Emitting Device and Electronic Device CRY1, CCNE2, IK CA1 2092/4885CA2 2052/4885INMT 2371/4885

“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.