SCHEMBL20152697

SCHEMBL20152697

CC1(C)c2cc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccc(-c6ccccc6)cc5)n4)cc3)ccc2-c2c3[nH]c4ccccc4c3cc3cccc1c23

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 2/20 0.34
HTR5A P47898 2/20 0.34
TDO2 P48775 4/20 0.33
BCHE P06276 1/20 0.33
NQO2 P16083 1/20 0.33
PGR P06401 1/20 0.32
KIF11 P52732 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
IDO1 P14902 2/20 0.32
CDK4 P11802 1/20 0.32
CCND1 P24385 1/20 0.32
PARP14 Q460N5 2/20 0.31

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
SCHEMBL20152834 0.83 BCHE (0.39) BCHEPGRKIF11MEN1KMT2A
SCHEMBL24041152 0.79 CDK4 (0.32) PGRKIF11MEN1KMT2ACDK4
SCHEMBL21151651 0.79 TDO2 (0.36) HTR2BHTR5ATDO2BCHENQO2
SCHEMBL23518252 0.77 PDK2 (0.42) MEN1KMT2A
SCHEMBL17714932 0.76 KIF11 (0.36) PGRKIF11MEN1KMT2ACDK4
SCHEMBL23518358 0.76 PDK2 (0.41) MEN1KMT2A
SCHEMBL23518239 0.74 PDK2 (0.38) MEN1KMT2A
SCHEMBL18878282 0.74 MEN1 (0.37) MEN1KMT2A
SCHEMBL18878316 0.74 MEN1 (0.37) MEN1KMT2A
SCHEMBL17151655 0.74 MEN1 (0.37) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 HTR2B 2847/4885HTR5A 3915/4885TDO2 1287/4885
US-10580996-B2 Polycyclic compound and organic light-emitting element comprising same CRY2, NR2E3, CRY1 HTR2B 2847/4885HTR5A 3915/4885TDO2 1287/4885

“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.