SCHEMBL16844232

SCHEMBL16844232

c1ccc2c(c1)Sc1ccccc1-c1c-2[nH]c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
ALOX15 P16050 2/20 0.51
KMT2A Q03164 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
ESR1 P03372 4/20 0.44
ESR2 Q92731 4/20 0.44
TUBB4A P04350 1/20 0.42
TUBB P07437 1/20 0.42
TUBA3C P0DPH7 1/20 0.42
TUBA1B P68363 1/20 0.42
TUBA4A P68366 1/20 0.42
TUBB4B P68371 1/20 0.42
TUBB3 Q13509 1/20 0.42
TUBB2A Q13885 1/20 0.42
TUBB8 Q3ZCM7 1/20 0.42
TUBA3E Q6PEY2 1/20 0.42
TUBA1A Q71U36 1/20 0.42
TUBA1C Q9BQE3 1/20 0.42
TUBB6 Q9BUF5 1/20 0.42
TUBB2B Q9BVA1 1/20 0.42

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
SCHEMBL16844358 0.77 FEN1 (0.44) MEN1ALOX15KMT2ATDP1ESR1
SCHEMBL19055245 0.75 PARP1 (0.51) MEN1ALOX15KMT2ATDP1ALDH1A1
SCHEMBL19048753 0.74 MEN1 (0.42) MEN1ALOX15KMT2ATDP1ESR1
SCHEMBL19055139 0.74 MEN1 (0.42) MEN1ALOX15KMT2ATDP1ESR1
SCHEMBL16107007 0.72 DRD2 (0.49) ESR1ESR2TUBB4ATUBBTUBA3C
SCHEMBL16844346 0.72 MEN1 (0.50) MEN1ALOX15KMT2ATDP1ESR1
SCHEMBL21309284 0.72 CDK1 (0.53) MEN1KMT2AESR1ESR2TUBB4A
SCHEMBL16107082 0.72 GSK3B (0.56) ESR1ESR2TUBB4ATUBBTUBA3C
SCHEMBL28725631 0.72 ESR1 (0.71) MEN1KMT2AESR1ESR2TUBB4A
SCHEMBL29541260 0.72 ESR1 (0.71) MEN1KMT2AESR1ESR2TUBB4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020209299-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE COMPRISING SAME 出光興産株式会社 2020-10-15 WO disclosed
WO-2020115933-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE USING SAME 出光興産株式会社 2020-06-11 WO disclosed
US-10008675-B2 Organic compound and organic electroluminescent element comprising same DOOSAN CORPORATION (KR) 2018-06-26 US disclosed
US-10008675-B2 Organic compound and organic electroluminescent element comprising same DOOSAN CORPORATION (KR) 2018-06-26 US disclosed
US-20160351825-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME DOOSAN CORPORATION (KR) 2016-12-01 US disclosed
US-20160351825-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME DOOSAN CORPORATION (KR) 2016-12-01 US disclosed
WO-2016013894-A2 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2016-01-28 WO disclosed
WO-2016013894-A2 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2016-01-28 WO disclosed
WO-2015093812-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 2015-06-25 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 (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-20160351825-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME OR10J3, ORAI2, ETV6 MEN1 2331/4885ALOX15 1222/4885KMT2A 1517/4885
US-10008675-B2 Organic compound and organic electroluminescent element comprising same OR10J3, ORAI2, ETV6 MEN1 2331/4885ALOX15 1222/4885KMT2A 1517/4885

“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.