SCHEMBL19038907

SCHEMBL19038907

C=COCCOc1ccc2ccc(OCCOC=C)cc2c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.53
▸ TDP1 Q9NUW8 2/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ NPC1 O15118 3/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ MAPT P10636 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ AGXT P21549 2/20 0.41
▸ NCF1 P14598 6/20 0.40
▸ PPARG P37231 1/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ HTT P42858 1/20 0.38
▸ DRD3 P35462 1/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA9 Q16790 1/20 0.37

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
SCHEMBL757853 0.93 KDM4E (0.65) KDM4ETDP1MAPK1NPC1RAB9A
SCHEMBL2449215 0.86 KDM4E (0.43) KDM4ETDP1MAPK1NPC1RAB9A
SCHEMBL419937 0.83 THRB (0.41) KDM4ETDP1MAPK1MAPTHTT
SCHEMBL3426128 0.81 MAPK1 (0.43) KDM4ETDP1MAPK1NPC1RAB9A
SCHEMBL2447823 0.81 KDM4E (0.51) KDM4EMAPTHTTALDH1A1
SCHEMBL419321 0.80 MAPK1 (0.44) KDM4ETDP1MAPK1NPC1RAB9A
SCHEMBL9416187 0.79 INPPL1 (0.42) KDM4ETDP1MAPK1NPC1MAPT
SCHEMBL1506243 0.79 THRB (0.33) KDM4ETDP1MAPK1
SCHEMBL15282329 0.78 MAPK1 (0.43) KDM4ETDP1MAPK1NPC1RAB9A
SCHEMBL1506206 0.78 LTA4H (0.44) MAPK1NPC1RAB9AMAPTSMN1; SMN2

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-20170183531-A1 COMPOUND FOR FORMING ORGANIC FILM, COMPOSITION FOR FORMING ORGANIC FILM, METHOD FOR FORMING ORGANIC FILM, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-06-29 — — US disclosed
US-20170184968-A1 COMPOUND FOR FORMING ORGANIC FILM, COMPOSITION FOR FORMING ORGANIC FILM, METHOD FOR FORMING ORGANIC FILM, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-06-29 — — 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-20170184968-A1 COMPOUND FOR FORMING ORGANIC FILM, COMPOSITION FOR FORMING ORGANIC FILM, METHOD FOR FORMING ORGANIC FILM, AND PATTERNING PROCESS CHRM1, MLX, OR10J3 KDM4E 592/4885TDP1 2282/4885MAPK1 984/4885

“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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