SCHEMBL21446443

SCHEMBL21446443

CC1(C)c2ccccc2-c2cc(Nc3ccc(-c4cccc5sc6ccccc6c45)cc3)ccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 2/20 0.35
▸ FLT1 P17948 2/20 0.35
▸ RPS6KB1 P23443 2/20 0.35
▸ KDR P35968 2/20 0.35
▸ FLT3 P36888 2/20 0.35
▸ FLT4 P35916 2/20 0.35
▸ AURKA O14965 1/20 0.35
▸ ROCK2 O75116 1/20 0.35
▸ FGFR1 P11362 1/20 0.35
▸ RPS6KA3 P51812 1/20 0.35
▸ ROCK1 Q13464 1/20 0.35
▸ AURKB Q96GD4 1/20 0.35
▸ PLK3 Q9H4B4 1/20 0.35
▸ IDO1 P14902 4/20 0.33
▸ PDK2 Q15119 2/20 0.33
▸ TDO2 P48775 1/20 0.32
▸ HIPK4 Q8NE63 1/20 0.32
▸ SRPK1 Q96SB4 1/20 0.32
▸ F9 P00740 1/20 0.31
▸ ALOX5 P09917 1/20 0.31

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
SCHEMBL17690164 0.93 PDK2 (0.38) CSF1RFLT1RPS6KB1KDRFLT3
SCHEMBL21446559 0.92 IDO1 (0.34) CSF1RFLT1RPS6KB1KDRFLT3
SCHEMBL23168504 0.87 PDK2 (0.35) FLT4IDO1PDK2
SCHEMBL19147809 0.86 ALOX5 (0.46) CSF1RFLT1RPS6KB1KDRFLT3
SCHEMBL25002056 0.86 PDK2 (0.36) PDK2F9BRDT
SCHEMBL23372605 0.86 PDK2 (0.36) PDK2F9BRDT
SCHEMBL23372570 0.85 PDK2 (0.37) IDO1PDK2TDO2F9ALOX5
SCHEMBL25003257 0.84 PDK2 (0.34) PDK2BRDT
SCHEMBL24969765 0.83 PDK2 (0.37) PDK2F9PTGIR
SCHEMBL23372563 0.83 PDK2 (0.34) IDO1PDK2PTGIRBRDT

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-20210147375-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2021-05-20 — — US disclosed
WO-2019192954-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-10-10 — — 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-20210147375-A1 MATERIALS FOR ELECTRONIC DEVICES PNMT, EFNA1, TES CSF1R 4064/4885FLT1 4110/4885RPS6KB1 3662/4885

“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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