SCHEMBL16746503

SCHEMBL16746503

CC1(C)/C(=C\c2ccc(Br)cc2)C(=O)c2ccccc21

nearest known ligand 0.77

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 1/20 0.43
ALPL P05186 1/20 0.42
ALPI P09923 1/20 0.42
PTPRC P08575 1/20 0.38
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
PIM1 P11309 2/20 0.37
PIM2 Q9P1W9 1/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
DRD3 P35462 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
PGR P06401 1/20 0.35
ACHE P22303 1/20 0.34

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
SCHEMBL16746500 0.87 HPGD (0.44) ALPLALPIMAOAMAOBMEN1
SCHEMBL11871293 0.87 HPGD (0.44) ALPLALPIMAOAMAOBMEN1
SCHEMBL11871299 0.87 HPGD (0.44) ALPLALPIMAOAMAOBMEN1
SCHEMBL12977432 0.82 ACHE (0.50) ALPLALPIMAOBGAAPGR
SCHEMBL12977427 0.82 ACHE (0.50) ALPLALPIMAOBGAAPGR
SCHEMBL12977423 0.76 MAPT (0.53) ALPLALPIPIM1PIM2MEN1
SCHEMBL12977425 0.76 MAPT (0.53) ALPLALPIPIM1PIM2MEN1
SCHEMBL3370471 0.75 PGR (0.41) PTPRCMAOAMEN1NPC1KMT2A
SCHEMBL3370477 0.75 PGR (0.41) PTPRCMAOAMEN1NPC1KMT2A
SCHEMBL15041025 0.73 KMT2A (0.63) ALPLALPIMAOBMEN1NPC1

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-11050027-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-06-29 US disclosed
US-20150144924-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2015-05-28 US disclosed
US-20150144924-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2015-05-28 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-11050027-B2 Condensed cyclic compound and organic light-emitting device including the same CCNT1, CRY1, CCNA1 ERBB2 4457/4885ALPL 3686/4885ALPI 4173/4885

“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.