SCHEMBL20364454

SCHEMBL20364454

Cc1cc(C(F)(F)F)ccc1-n1c2ccc(-c3ccccc3)cc2c2cc(-c3ccccc3)ccc21

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 4/20 0.46
▸ DHODH Q02127 1/20 0.43
▸ CCNE2 O96020 1/20 0.38
▸ CDK4 P11802 1/20 0.38
▸ CCND1 P24385 1/20 0.38
▸ CCNE1 P24864 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ GLO1 Q04760 1/20 0.37
▸ DGAT1 O75907 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ ICMT O60725 2/20 0.35
▸ MAT2A P31153 1/20 0.35
▸ BACE1 P56817 2/20 0.35
▸ PKM P14618 1/20 0.35

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
SCHEMBL18374182 0.89 KIF11 (0.49) KIF11DHODHGLO1DGAT1KCNH2
SCHEMBL18374152 0.87 KIF11 (0.41) KIF11DHODHGLO1DGAT1KCNH2
SCHEMBL19795555 0.87 KIF11 (0.41) KIF11DHODHGLO1DGAT1KCNH2
SCHEMBL17950229 0.86 KIF11 (0.46) KIF11DHODHGLO1DGAT1KCNH2
SCHEMBL17950224 0.86 KIF11 (0.46) KIF11DHODHGLO1DGAT1KCNH2
SCHEMBL19795557 0.86 KIF11 (0.41) KIF11DHODHGLO1ICMTMAT2A
SCHEMBL18361178 0.84 KIF11 (0.41) KIF11DHODHCCNE2CDK4CCND1
SCHEMBL17950225 0.83 KIF11 (0.46) KIF11DHODHGLO1DGAT1KCNH2
SCHEMBL17950236 0.83 KIF11 (0.46) KIF11DHODHGLO1DGAT1KCNH2
SCHEMBL18361209 0.83 KIF11 (0.43) KIF11DHODHGLO1DGAT1KCNH2

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-20180198075-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-07-12 — — 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-20180198075-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES C1R, ORC3, OR10J3 KIF11 4043/4885DHODH 4336/4885CCNE2 813/4885

“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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