SCHEMBL17299442

SCHEMBL17299442

c1ccc2c(c1)sc1c2ccc2ccc3c4ccccc4n(-c4ccc(-c5cn6ccccc6n5)cc4)c3c21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 15/20 0.41
▸ NPC1 O15118 14/20 0.41
▸ KDM4E B2RXH2 12/20 0.41
▸ POLB P06746 3/20 0.41
▸ GFER P55789 3/20 0.41
▸ PKM P14618 5/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.38
▸ SMN1; SMN2 Q16637 10/20 0.38
▸ ALDH1A1 P00352 9/20 0.38
▸ MAPK1 P28482 3/20 0.38
▸ KMT2A Q03164 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ MIF P14174 1/20 0.37
▸ HPGD P15428 3/20 0.36
▸ NFKB1 P19838 2/20 0.36
▸ NFKB2 Q00653 2/20 0.36
▸ RELA Q04206 2/20 0.36
▸ ALOX12 P18054 1/20 0.36

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
SCHEMBL10014569 0.92 RAB9A (0.44) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL14951289 0.90 RAB9A (0.42) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL10014508 0.87 RAB9A (0.44) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL10014550 0.87 RAB9A (0.44) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL14951303 0.85 RAB9A (0.40) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL15126804 0.84 RAB9A (0.44) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL14951496 0.84 RAB9A (0.44) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL14951142 0.84 RAB9A (0.42) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL15003373 0.84 RAB9A (0.39) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL19037150 0.83 RAB9A (0.44) RAB9ANPC1KDM4EPOLBGFER

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10003031-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2018-06-19 — — US disclosed
US-10003031-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2018-06-19 — — US disclosed
US-20150349276-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2015-12-03 — — US disclosed
US-20150349276-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2015-12-03 — — 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 (2 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-20150349276-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF ORAI2, ESR1, OR10J3 RAB9A 3586/4885NPC1 4225/4885KDM4E 636/4885
US-10003031-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof ORAI2, ESR1, OR10J3 RAB9A 3586/4885NPC1 4225/4885KDM4E 636/4885

“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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