SCHEMBL13433012

SCHEMBL13433012

CC1(C)c2ccccc2-c2cccc(-c3ccc4[nH]c5ccccc5c4c3)c21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.42
KIF11 P52732 8/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 3/20 0.41
HSD17B10 Q99714 2/20 0.41
MEN1 O00255 2/20 0.41
HPGD P15428 1/20 0.41
PGR P06401 1/20 0.39
GPR3 P46089 1/20 0.39
HCRTR1 O43613 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36

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
SCHEMBL19522682 0.88 AHR (0.41) AHRKIF11KDM4EALDH1A1KMT2A
SCHEMBL19061441 0.86 AHR (0.42) AHRKIF11KDM4EALDH1A1KMT2A
SCHEMBL13433089 0.86 AHR (0.44) AHRKIF11KDM4EALDH1A1KMT2A
SCHEMBL13432985 0.84 AHR (0.43) AHRKIF11KDM4EALDH1A1KMT2A
SCHEMBL16442721 0.84 AHR (0.43) AHRKIF11KDM4EALDH1A1KMT2A
SCHEMBL19041626 0.84 AHR (0.40) AHRKIF11KDM4EALDH1A1KMT2A
SCHEMBL15589041 0.83 AHR (0.42) AHRKIF11KDM4EALDH1A1KMT2A
SCHEMBL19061342 0.83 AHR (0.42) AHRKIF11KDM4EALDH1A1KMT2A
SCHEMBL25972324 0.82 AHR (0.36) AHRKIF11KDM4EALDH1A1KMT2A
SCHEMBL25972312 0.82 KIF11 (0.34) AHRKIF11KDM4EALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100069647-A1 Carbazole Derivative, Light-Emitting Element Material, Light-Emitting Element, and Light-Emitting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2010-03-18 US disclosed
US-20100069647-A1 Carbazole Derivative, Light-Emitting Element Material, Light-Emitting Element, and Light-Emitting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2010-03-18 US disclosed
WO-2010005066-A1 CARBAZOLE DERIVATIVE, LIGHT-EMITTING ELEMENT MATERIAL, LIGHT-EMITTING ELEMENT, AND LIGHT-EMITTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2010-01-14 WO 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-20100069647-A1 Carbazole Derivative, Light-Emitting Element Material, Light-Emitting Element, and Light-Emitting Device CRY1, CHRM1, CYP1A1 AHR 651/4885KIF11 3028/4885KDM4E 3714/4885

“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.