SCHEMBL26411515

SCHEMBL26411515

N#Cc1cc(C#N)cc(-c2cccc(-c3cc(-c4ccccc4)c4c(c3-c3ccccc3)-c3cccc5cccc-4c35)c2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.36
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
GABRA5 P31644 2/20 0.34
GABRA3 P34903 2/20 0.34
GABRA1 P14867 1/20 0.34
GRM5 P41594 1/20 0.34
MAOB P27338 1/20 0.34
ADORA2A P29274 2/20 0.33
METAP2 P50579 1/20 0.33
ADORA1 P30542 1/20 0.33
ALDH1A3 P47895 1/20 0.33
PDK2 Q15119 1/20 0.33
IDO1 P14902 1/20 0.33
ALDH1A1 P00352 3/20 0.33
TSHR P16473 2/20 0.33
MAPK1 P28482 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL24067764 0.95 ADRA2C (0.36) ADRA2CGABRG2GABRB3GABRA5GABRA3
SCHEMBL24067782 0.94 ADRA2C (0.43) ADRA2CGABRG2GABRB3GABRA5GABRA3
SCHEMBL24067827 0.94 ADRA2C (0.43) ADRA2CGABRG2GABRB3GABRA5GABRA3
SCHEMBL24067903 0.94 ALDH1A1 (0.35) ADRA2CGABRG2GABRB3GABRA5GABRA3
SCHEMBL24067814 0.93 ADRA2C (0.36) ADRA2CGABRG2GABRB3GABRA5GABRA3
SCHEMBL24067743 0.92 NTRK1 (0.36) ADRA2CGABRG2GABRB3GABRA5GABRA3
SCHEMBL24067719 0.91 ADRA2C (0.45) ADRA2CGABRG2GABRB3GABRA5GABRA3
SCHEMBL24067771 0.90 ALDH1A1 (0.39) ADRA2CGABRG2GABRB3GABRA5GABRA3
SCHEMBL26411465 0.90 ALDH1A1 (0.39) ADRA2CGABRG2GABRB3GABRA5GABRA3
SCHEMBL26411579 0.89 ADRA2C (0.41) ADRA2CGABRG2GABRB3GABRA5GABRA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230128259-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2023-04-27 US disclosed
US-20230128259-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2023-04-27 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-20230128259-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME L1CAM, CRY1, CRY2 ADRA2C 1952/4885GABRG2 3862/4885GABRB3 3937/4885

“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.