SCHEMBL18386502

SCHEMBL18386502

CCCCCCCCCCNc1ccc2sc(C)cc2c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 1/20 0.48
▸ KCNH3 Q9ULD8 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ EPHX1 P07099 2/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ PLK1 P53350 3/20 0.37
▸ DNM2 P50570 4/20 0.37
▸ ADRA2A P08913 1/20 0.37
▸ TRPM5 Q9NZQ8 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ RIPK1 Q13546 1/20 0.34

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
SCHEMBL18415591 0.78 ABL1 (0.52) ABL1KCNH3ALDH1A1EPHX1CNR2
SCHEMBL18544110 0.74 ABL1 (0.46) ABL1KCNH3ALDH1A1PLK1ADRA2A
SCHEMBL11686248 0.73 EPHX1 (0.62) ABL1KCNH3ALDH1A1EPHX1HDAC1
SCHEMBL12260011 0.73 ABL1 (0.54) ABL1KCNH3ALDH1A1EPHX1PLK1
SCHEMBL10583953 0.73 EPHX1 (0.62) ABL1KCNH3ALDH1A1EPHX1HDAC1
SCHEMBL11683181 0.73 EPHX1 (0.62) ABL1KCNH3ALDH1A1EPHX1HDAC1
SCHEMBL11129979 0.73 EPHX1 (0.62) ABL1KCNH3ALDH1A1EPHX1HDAC1
SCHEMBL12260009 0.73 ABL1 (0.54) ABL1KCNH3ALDH1A1EPHX1PLK1
SCHEMBL11684553 0.73 EPHX1 (0.62) ABL1KCNH3ALDH1A1EPHX1HDAC1
SCHEMBL11683978 0.73 EPHX1 (0.62) ABL1KCNH3ALDH1A1EPHX1HDAC1

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-20170018724-A1 ORGANIC TRANSISTOR, COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, MATERIAL FOR ORGANIC TRANSISTOR, COATING SOLUTION FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, METHOD FOR MANUFACTURING ORGANIC TRANSISTOR, METHOD FOR MANUFACTURING ORGANIC SEMICONDUCTOR FILM, ORGANIC SEMICONDUCTOR FILM FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, AND METHOD FOR SYNTHESIZING ORGANIC SEMICONDUCTOR MATERIAL FUJIFILM CORPORATION (JP) 2017-01-19 — — 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-20170018724-A1 ORGANIC TRANSISTOR, COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, MATERIAL FOR ORGANIC TRANSISTOR, COATING SOLUTION FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, METHOD FOR MANUFACTURING ORGANIC TRANSISTOR, METHOD FOR MANUFACTURING ORGANIC SEMICONDUCTOR FILM, ORGANIC SEMICONDUCTOR FILM FOR NON-LIGHT-EMITTING ORGANIC SEMICONDUCTOR DEVICE, AND METHOD FOR SYNTHESIZING ORGANIC SEMICONDUCTOR MATERIAL STRA6, NONO, OR10J3 ABL1 965/4885KCNH3 998/4885ALDH1A1 2938/4885

“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.

Send feedback