SCHEMBL19786740

SCHEMBL19786740

c1ccc(C2(c3ccc(-n4c5c6ccccc6ccc5c5c6c7ccccc7[nH]c6c6ccccc6c54)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 8/20 0.40
CCND1 P24385 8/20 0.40
CCNE2 O96020 3/20 0.40
CCNE1 P24864 3/20 0.40
CDK2 P24941 3/20 0.40
GSK3B P49841 2/20 0.40
CCNB2 O95067 1/20 0.40
PRKCG P05129 1/20 0.40
PRKCB P05771 1/20 0.40
CDK1 P06493 1/20 0.40
CCNB1 P14635 1/20 0.40
PRKCA P17252 1/20 0.40
MAP3K9 P80192 1/20 0.40
MAP3K11 Q16584 1/20 0.40
CCNB3 Q8WWL7 1/20 0.40
KIF11 P52732 1/20 0.38
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37

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
SCHEMBL21432035 0.86 GABRP (0.37) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL19786526 0.85 KIF11 (0.49) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL19786739 0.84 KIF11 (0.46) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL19786742 0.82 CDK4 (0.36) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL19786586 0.82 KDM4E (0.34) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL21432066 0.81 CDK4 (0.48) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL19786547 0.80 CDK4 (0.32) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL21432053 0.80 KIF11 (0.46) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL19786530 0.78 KIF11 (0.42) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL21432063 0.76 GABRP (0.40) CDK4CCND1CCNE2CCNE1CDK2

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-20190300535-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2019-10-03 US disclosed
WO-2018012781-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2018-01-18 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 (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-20190300535-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF ORC3, OR51E2, ORAI2 CDK4 1783/4885CCND1 2544/4885CCNE2 257/4885

“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.