SCHEMBL20175707

SCHEMBL20175707

CC1(C)c2ccccc2-c2c(Br)cc3c([nH]c4ccccc43)c21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.39
CCNE2 O96020 4/20 0.38
CDK4 P11802 4/20 0.38
CCND1 P24385 4/20 0.38
CCNE1 P24864 4/20 0.38
CDK2 P24941 4/20 0.38
CDK1 P06493 4/20 0.38
CAMK2B Q13554 3/20 0.38
CAMK2G Q13555 3/20 0.38
CAMK2D Q13557 3/20 0.38
CAMK2A Q9UQM7 3/20 0.38
CCNB2 O95067 3/20 0.38
CCNB1 P14635 3/20 0.38
CCNB3 Q8WWL7 3/20 0.38
PRKACA P17612 1/20 0.38
PRKACG P22612 1/20 0.38
PRKACB P22694 1/20 0.38
PARP14 Q460N5 6/20 0.36
MAPT P10636 2/20 0.36
NPC1 O15118 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
SCHEMBL21941921 0.90 PGR (0.40) KIF11CCNE2CDK4CCND1CCNE1
SCHEMBL24593285 0.85 KIF11 (0.37) KIF11CCNE2CDK4CCND1CCNE1
SCHEMBL24730498 0.79 PGR (0.40) KIF11CCNE2CDK4CCND1CCNE1
SCHEMBL15126748 0.77 CHEK1 (0.43) KIF11CCNE2CDK4CCND1CCNE1
SCHEMBL29506381 0.77 CHEK1 (0.43) KIF11CCNE2CDK4CCND1CCNE1
SCHEMBL24730282 0.77 BCHE (0.38) KIF11CCNE2CDK4CCND1CCNE1
SCHEMBL21151651 0.77 TDO2 (0.36) KIF11PARP14MAPTIDO1TDO2
SCHEMBL29819516 0.76 KIF11 (0.47) KIF11PARP14MAPTPGRTDO2
SCHEMBL1707718 0.76 KIF11 (0.47) KIF11PARP14MAPTPGRTDO2
SCHEMBL20152834 0.75 BCHE (0.39) KIF11CCNE2CDK4CCND1CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180141957-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2018-05-24 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-20180141957-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF PIEZO1, OCIAD1, LEF1 KIF11 1634/4885CCNE2 374/4885CDK4 1869/4885

“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.