SCHEMBL13345808

SCHEMBL13345808

Cc1ccc(-c2ccc(-c3c(C(F)(F)F)cc(-c4ccc(C)cc4)c4ccccc34)c3ccccc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 1/20 0.43
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42
AR P10275 3/20 0.39
PDK2 Q15119 1/20 0.38
COMT P21964 1/20 0.37
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
GPR84 Q9NQS5 1/20 0.36
TRPA1 O75762 1/20 0.36
HSD11B1 P28845 2/20 0.36
ACHE P22303 1/20 0.36
MAPT P10636 2/20 0.35
S1PR1 P21453 1/20 0.35
S1PR3 Q99500 1/20 0.35
CYP11B1 P15538 2/20 0.35
CYP11B2 P19099 2/20 0.35
NPC1 O15118 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL20637767 0.76 ACHE (0.47) ENPP1COMTGPR84ACHENPC1
SCHEMBL26332330 0.75 COMT (0.53) COMTGPR84ACHEMAPTNPC1
SCHEMBL27638536 0.72 AKR1C3 (0.55) AKR1C3AKR1C2ARPDK2PDE3B
SCHEMBL19323000 0.72 AKR1C3 (0.58) AKR1C3AKR1C2ARPDK2PDE3B
SCHEMBL1047574 0.72 HSD11B1 (0.52) ENPP1AKR1C3AKR1C2ARTRPA1
SCHEMBL23966251 0.71 COMT (0.50) COMTGPR84ACHEMAPTNPC1
SCHEMBL13995133 0.71 COMT (0.39) ENPP1COMTGPR84MAPTNPC1
SCHEMBL28922699 0.71 HSD11B1 (0.50) ENPP1AKR1C3AKR1C2ARPDK2
SCHEMBL13658640 0.70 COMT (0.41) ENPP1COMTGPR84ACHEMAPT
SCHEMBL18948607 0.70 S1PR1 (0.49) ARPDK2PDE3BPDE3ATRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024115426-A1 POLYMERS CONTAINING SPIROTRUXENE DERIVATIVES AS THE REPEATING UNITS, AND ELECTROLUMINESCENT DEVICES CONTAINING SAID POLYMERS MERCK PATENT GMBH (DE) 2024-06-06 WO disclosed
EP-3559078-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-10-25 EP disclosed
US-20200144505-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2020-05-07 US disclosed
US-20190322796-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-10-24 US disclosed
EP-1831326-B1 ELECTROLUMINESCENT POLYMERS AND THEIR USE MERCK PATENT GMBH (DE) 2017-03-01 EP disclosed
US-20100108989-A1 ELECTROLUMINESCENT POLYMERS AND USE THEREOF MERCK PATENT GMBH (DE) 2010-05-06 US disclosed
US-20100108989-A1 ELECTROLUMINESCENT POLYMERS AND USE THEREOF MERCK PATENT GMBH (DE) 2010-05-06 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-20100108989-A1 ELECTROLUMINESCENT POLYMERS AND USE THEREOF MAP1LC3C, EPCAM, MAP1LC3A ENPP1 674/4885AKR1C3 3844/4885AKR1C2 3309/4885

“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.