SCHEMBL19485307

SCHEMBL19485307

c1ccc(N(c2ccc(-c3cc(-c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4)c4[nH]c5ccccc5c4c3)cc2)c2cccc3ccccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.40
BCHE P06276 1/20 0.38
HTR2B P41595 2/20 0.37
HTR5A P47898 2/20 0.37
CDK4 P11802 5/20 0.36
CCND1 P24385 5/20 0.36
CCNB2 O95067 1/20 0.36
CCNE2 O96020 1/20 0.36
CDK1 P06493 1/20 0.36
CCNB1 P14635 1/20 0.36
CCNE1 P24864 1/20 0.36
CDK2 P24941 1/20 0.36
CCNB3 Q8WWL7 1/20 0.36
PARP14 Q460N5 5/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33

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
SCHEMBL4581380 0.90 KIF11 (0.44) KIF11BCHEHTR2BHTR5ACDK4
SCHEMBL19485322 0.90 KIF11 (0.33) KIF11BCHEHTR2BHTR5ACDK4
SCHEMBL10003892 0.88 HPGD (0.40) KIF11BCHEHTR2BHTR5APARP14
SCHEMBL19485306 0.88 HPGD (0.40) KIF11BCHEHTR2BHTR5APARP14
SCHEMBL18905175 0.86 HPGD (0.42) KIF11BCHEHTR2BHTR5APARP14
SCHEMBL19485311 0.85 HPGD (0.43) KIF11BCHEHTR2BHTR5AHPGD
SCHEMBL19485308 0.85 HTR2B (0.45) KIF11BCHEHTR2BHTR5ACDK4
SCHEMBL15926331 0.84 CDK4 (0.41) KIF11BCHEHTR2BHTR5ACDK4
SCHEMBL31624061 0.84 CDK4 (0.41) KIF11BCHEHTR2BHTR5ACDK4
SCHEMBL15926345 0.84 CDK4 (0.41) KIF11BCHEHTR2BHTR5ACDK4

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-10319923-B2 Compound for organic electronic element, organic electronic element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2019-06-11 US disclosed
US-10319922-B2 Compound for organic electronic element, organic electronic element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2019-06-11 US disclosed
US-20170301868-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2017-10-19 US disclosed
US-20170301868-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2017-10-19 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 (3 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-20170301868-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF PIEZO1, OCIAD1, GPX1 KIF11 1993/4885BCHE 1806/4885HTR2B 4745/4885
US-10319922-B2 Compound for organic electronic element, organic electronic element comprising the same and electronic device thereof PIEZO1, GPX1, OCIAD1 KIF11 1769/4885BCHE 2276/4885HTR2B 4619/4885
US-10319923-B2 Compound for organic electronic element, organic electronic element comprising the same and electronic device thereof PIEZO1, GPX1, OCIAD1 KIF11 1769/4885BCHE 2276/4885HTR2B 4619/4885

“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.