SCHEMBL20152834

SCHEMBL20152834

CC1(C)c2ccccc2-c2c3[nH]c4ccccc4c3cc3cccc1c23

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.39
KIF11 P52732 3/20 0.38
CLK1 P49759 1/20 0.37
DYRK1A Q13627 1/20 0.37
PARP1 P09874 1/20 0.37
PGR P06401 1/20 0.37
CHEK1 O14757 1/20 0.37
PARP14 Q460N5 4/20 0.36
CDK4 P11802 5/20 0.35
CCND1 P24385 5/20 0.35
CCNB2 O95067 3/20 0.35
CCNE2 O96020 3/20 0.35
CDK1 P06493 3/20 0.35
MAPT P10636 3/20 0.35
CCNB1 P14635 3/20 0.35
CCNE1 P24864 3/20 0.35
CDK2 P24941 3/20 0.35
CCNB3 Q8WWL7 3/20 0.35
CAMK2B Q13554 3/20 0.35
CAMK2G Q13555 3/20 0.35

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
SCHEMBL23722785 0.85 KIF11 (0.39) KIF11CDK4CCND1CCNB2CCNE2
SCHEMBL20160592 0.83 PARP1 (0.43) CLK1DYRK1APARP1CHEK1CDK4
SCHEMBL20152697 0.83 HTR2B (0.34) BCHEKIF11PGRPARP14CDK4
SCHEMBL25983472 0.81 CDK4 (0.33) BCHEKIF11CLK1DYRK1APARP1
SCHEMBL25983418 0.79 PARP14 (0.39) BCHEKIF11PARP1PGRCHEK1
SCHEMBL15840151 0.78 PGR (0.48) BCHEKIF11PGRCHEK1PARP14
SCHEMBL21941921 0.78 PGR (0.40) BCHEKIF11PARP1PGRCHEK1
SCHEMBL24730498 0.78 PGR (0.40) KIF11PARP1PGRCHEK1PARP14
SCHEMBL20437695 0.75 KIF11 (0.45) BCHEKIF11PGRCHEK1PARP14
SCHEMBL20175707 0.75 KIF11 (0.39) BCHEKIF11PARP1PGRCHEK1

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
EP-3305765-B1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEMICAL LTD (KR) 2021-08-04 EP disclosed
US-10580996-B2 Polycyclic compound and organic light-emitting element comprising same LG CHEM, LTD. (KR) 2020-03-03 US disclosed
US-20180138421-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-17 US disclosed
US-20180138421-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-17 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-20180138421-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME CRY2, NR2E3, CRY1 BCHE 3627/4885KIF11 1647/4885CLK1 1491/4885
US-10580996-B2 Polycyclic compound and organic light-emitting element comprising same CRY2, NR2E3, CRY1 BCHE 3627/4885KIF11 1647/4885CLK1 1491/4885

“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.