SCHEMBL25490702

SCHEMBL25490702

Cc1ccc2c3cc(C(C)(C)C)ccc3n(C)c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.46
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
TSHR P16473 1/20 0.42
HTR1D P28221 1/20 0.41
MAPT P10636 5/20 0.39
KDM4E B2RXH2 4/20 0.39
HTT P42858 2/20 0.39
APAF1 O14727 1/20 0.39
PKM P14618 1/20 0.39
IDO1 P14902 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39
MCL1 Q07820 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
RORA P35398 2/20 0.38
RORC P51449 2/20 0.38
RORB Q92753 2/20 0.38
PGR P06401 2/20 0.38

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
SCHEMBL20096916 0.93 KIF11 (0.49) KIF11BCHEACHETSHRHTR1D
SCHEMBL2604388 0.91 TSHR (0.46) KIF11BCHEACHETSHRHTR1D
SCHEMBL12611168 0.85 HTR1D (0.47) KIF11BCHEACHEHTR1DMAPT
SCHEMBL20466817 0.85 BCHE (0.54) KIF11BCHEACHEMAPTKDM4E
SCHEMBL2604384 0.85 HTR1D (0.50) KIF11BCHEACHETSHRHTR1D
SCHEMBL10133739 0.83 KIF11 (0.56) KIF11TSHRHTR1DMAPTKDM4E
SCHEMBL25882732 0.81 TSHR (0.41) KIF11TSHRHTR1DMAPTMCL1
SCHEMBL25058960 0.81 TSHR (0.41) KIF11TSHRHTR1DMAPTPKM
SCHEMBL16303830 0.81 TSHR (0.45) KIF11BCHEACHETSHRHTR1D
SCHEMBL12611419 0.81 KIF11 (0.55) KIF11TSHRHTR1DMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159578-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-05-25 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-20230159578-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OXER1, OPRD1, DRD3 KIF11 2868/4885BCHE 1406/4885ACHE 453/4885

“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.