SCHEMBL13506801

SCHEMBL13506801

Cn1c2cc(-c3ccc(C(C)(C)C)cc3)ccc2c2c3ccc4c(c3ccc21)c1ccc(-c2ccc(C(C)(C)C)cc2)cc1n4C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ APOBEC3G Q9HC16 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ KIF11 P52732 4/20 0.38
▸ RXRA P19793 1/20 0.37
▸ RXRB P28702 1/20 0.37
▸ MAOB P27338 1/20 0.35
▸ GRM2 Q14416 1/20 0.35
▸ GSK3B P49841 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ LIMK1 P53667 2/20 0.33
▸ HTR1D P28221 1/20 0.33
▸ L3MBTL1 Q9Y468 2/20 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
SCHEMBL13507999 0.83 LIMK1 (0.45) ALDH1A1KDM4EPOLBHPGDALOX15
SCHEMBL21454582 0.83 KIF11 (0.45) ALDH1A1KDM4EPOLBHPGDALOX15
SCHEMBL13507038 0.81 RXRA (0.39) ALDH1A1KDM4EPOLBHSD17B10RXRA
SCHEMBL13507562 0.81 MAOB (0.51) POLBRXRARXRBMAOBGRM2
SCHEMBL13507094 0.80 KIF11 (0.35) ALDH1A1KDM4EPOLBHPGDALOX15
SCHEMBL13506962 0.77 RXRA (0.52) ALDH1A1KDM4EPOLBHPGDHSD17B10
SCHEMBL25523206 0.77 KIF11 (0.51) ALDH1A1KDM4EPOLBHPGDHSD17B10
SCHEMBL13506806 0.77 L3MBTL1 (0.37) POLBRXRARXRBMAOBLIMK1
SCHEMBL13507026 0.76 KIF11 (0.38) ALDH1A1KDM4EHPGDHSD17B10TDP1
SCHEMBL24601672 0.75 KIF11 (0.36) ALDH1A1KDM4EPOLBHPGDALOX15

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-20100032658-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 — — US disclosed
US-20100032658-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 — — 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-20100032658-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, OCIAD2, ORMDL3 ALDH1A1 119/4885KDM4E 3009/4885POLB 1769/4885

“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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