SCHEMBL15315973

SCHEMBL15315973

c1ccc(-c2cc(-c3ccccc3)cc(-n3ccnc3-c3ccccc3)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK9 P45984 1/20 0.53
MAPK10 P53779 1/20 0.53
KDR P35968 16/20 0.51
FLT1 P17948 3/20 0.44
FLT4 P35916 3/20 0.44
ESR1 P03372 1/20 0.41
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40

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
SCHEMBL15746082 0.96 MAPK9 (0.49) MAPK9MAPK10KDRFLT1FLT4
SCHEMBL528245 0.85 MAPK9 (0.54) MAPK9MAPK10KDRFLT1FLT4
Benzene SCHEMBL27839441 0.85 MAPK9 (0.54) MAPK9MAPK10KDRFLT1FLT4
SCHEMBL27917408 0.84 KDR (0.64) MAPK9MAPK10KDRFLT1FLT4
Hydrochloric Acid SCHEMBL27683877 0.83 MAPK9 (0.53) MAPK9MAPK10KDRFLT1FLT4
SCHEMBL29040464 0.83 MAPK9 (0.53) MAPK9MAPK10KDRFLT1FLT4
SCHEMBL5698561 0.80 MAPK9 (0.62) MAPK9MAPK10KDRFLT1FLT4
SCHEMBL10035826 0.80 KDR (0.40) MAPK9MAPK10KDRFLT1FLT4
SCHEMBL12797971 0.79 KDR (0.43) MAPK9MAPK10KDRFLT1FLT4
SCHEMBL3815157 0.79 KDR (0.46) MAPK9MAPK10KDRFLT1FLT4

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-20130270541-A1 IMIDAZOLE COMPOUND PRODUCTION METHOD, IMIDAZOLE COMPOUND, IMIDAZOLE-BASED COMPOUND, ORGANIC METAL COMPLEX, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2013-10-17 US disclosed
US-20130270541-A1 IMIDAZOLE COMPOUND PRODUCTION METHOD, IMIDAZOLE COMPOUND, IMIDAZOLE-BASED COMPOUND, ORGANIC METAL COMPLEX, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2013-10-17 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-20130270541-A1 IMIDAZOLE COMPOUND PRODUCTION METHOD, IMIDAZOLE COMPOUND, IMIDAZOLE-BASED COMPOUND, ORGANIC METAL COMPLEX, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE NFXL1, NFE2L2, ZC3HAV1L MAPK9 1332/4885MAPK10 2857/4885KDR 215/4885

“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.