SCHEMBL20152784

SCHEMBL20152784

CC1(C)c2ccccc2-c2c3c1cccc3cc1c3ccc4ccccc4c3n(-c3ccc(C#N)cc3)c21

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 4/20 0.40
▸ PDPK1 O15530 1/20 0.37
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.31
▸ ALK Q9UM73 1/20 0.31
▸ STK10 O94804 1/20 0.31
▸ SLK Q9H2G2 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ HTT P42858 1/20 0.30

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
SCHEMBL20152766 0.89 MAPT (0.33) PGRKDM4EALDH1A1MAPT
SCHEMBL20152614 0.88 PGR (0.41) PGRPDPK1
SCHEMBL20152720 0.88 PGR (0.39) PGRPDPK1CA1CA2ALK
SCHEMBL20152824 0.88 PGR (0.39) PGRPDPK1CA1CA2NPSR1
SCHEMBL20152775 0.87 KDM4E (0.31) KDM4EALDH1A1MAPT
SCHEMBL20152768 0.87 PDE6D (0.35) KDM4EALDH1A1MAPT
SCHEMBL20152772 0.87 CYP1A2 (0.32) PGRALDH1A1LMNAMAPTHPGD
SCHEMBL20152805 0.86 PGR (0.41) PGRALK
SCHEMBL20152767 0.86 ALDH1A1 (0.32) ALDH1A1MAPT
SCHEMBL20152789 0.83 ALDH1A1 (0.31) KDM4EALDH1A1MAPT

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 PGR 570/4885PDPK1 3828/4885CA1 2880/4885
US-10580996-B2 Polycyclic compound and organic light-emitting element comprising same CRY2, NR2E3, CRY1 PGR 570/4885PDPK1 3828/4885CA1 2880/4885

“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.

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