SCHEMBL8613162

SCHEMBL8613162

C=CCc1ccccc1NC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 2/20 0.45
ADRA2B P18089 1/20 0.45
ALDH1A1 P00352 3/20 0.43
GABRA1 P14867 2/20 0.42
GABRB2 P47870 2/20 0.42
KDM4E B2RXH2 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
USP2 O75604 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
RECQL P46063 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
AR P10275 1/20 0.38
ADRB2 P07550 3/20 0.38
ADRB1 P08588 3/20 0.38
LMNA P02545 2/20 0.38
HTR1A P08908 1/20 0.38

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
SCHEMBL176287 0.83 ADRA2C (0.47) ADRA2CADRA2BALDH1A1GABRA1GABRB2
SCHEMBL14497148 0.80 ALDH1A1 (0.36) ADRA2CADRA2BALDH1A1KDM4ETDP1
SCHEMBL3635884 0.79 ATP4A (0.44) ALDH1A1KDM4ETDP1USP2POLB
SCHEMBL14236920 0.79 ADRA2C (0.45) ADRA2CADRA2BALDH1A1GABRA1GABRB2
SCHEMBL9416673 0.79 ADRA2C (0.45) ADRA2CADRA2BALDH1A1GABRA1GABRB2
SCHEMBL11815807 0.79 GABRA1 (0.47) ADRA2CADRA2BALDH1A1GABRA1GABRB2
SCHEMBL6761344 0.79 ADRA2C (0.45) ADRA2CADRA2BALDH1A1GABRA1GABRB2
SCHEMBL16899960 0.79 ADRA2C (0.42) ADRA2CADRA2BALDH1A1GABRA1GABRB2
SCHEMBL5367364 0.79 ADRA2C (0.44) ADRA2CADRA2BALDH1A1GABRA1GABRB2
SCHEMBL11034063 0.78 ADRA2B (0.44) ADRA2CADRA2BALDH1A1GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110669058-A Tricyclic quinolone carboxylic acid and preparation method thereof 江西农业大学 2020-01-10 CN claimed
EP-4692055-A1 THIOL COMPOUND AJINOMOTO CO., INC. (JP) 2026-02-11 EP disclosed
US-20260008904-A1 THIOL COMPOUND AJINOMOTO CO., INC. (JP) 2026-01-08 US disclosed
WO-2024204052-A1 THIOL COMPOUND 味の素株式会社 2024-10-03 WO disclosed
EP-3582783-B1 7-MEMBERED AZA-HETEROCYCLIC CONTAINING DELTA-OPIOID RECEPTOR MODULATING COMPOUNDS, METHODS OF USING AND MAKING THE SAME TREVENA INC (US) 2023-06-07 EP disclosed
WO-2023061998-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-04-20 WO disclosed
EP-3303317-B1 METHODS AND COMPOSITIONS FOR INHIBITING THE INTERACTION OF MENIN WITH MLL PROTEINS KURA ONCOLOGY INC (US) 2021-10-06 EP disclosed
CN-110669058-A Tricyclic quinolone carboxylic acid and preparation method thereof 江西农业大学 2020-01-10 CN disclosed
US-7638546-B1 Imidazolyl derivatives IPSEN PHARMA S.A.S. (FR) 2009-12-29 US disclosed
EP-0554904-B1 Organosilicon polymers, and dyes, exhibiting nonlinear optical response ALLIANT TECHSYSTEMS INC (US) 1998-06-10 EP disclosed
US-5714304-A AN ORGANOSILICON CROSSLINKED POLYMER IS THE REACTION PRODUCT OF ATLEAST ONE CYCLIC POLYSILOXANE HAVING ATLEAST TWO HYDROSILATION REACTIVE GROUPS, AN ORGANIC DYE WITH ELECTRON ACCEPTOR AND DONOR GROUPS WITH DOUBLE BOND, AND A POLYENE HERCULES INCORPORATED (US) 1998-02-03 US disclosed
US-5663308-A DYES CONTAINING ELECTRON DONOR/ACEPTOR GROUPS LINKED BY DELOCALIZED PI ELECTRON SYSTEM AND TWO OR MORE PENDANT GROUPS HERCULES INCORPORATED (US) 1997-09-02 US disclosed
US-5605726-A FILMS, SEMICONDUCTORS HERECULES INCORPORATED (US) 1997-02-25 US disclosed
US-5298588-A Organosilicon polymers, and dyes, exhibiting nonlinear optical response HERCULES INCORPORATED (US) 1994-03-29 US disclosed
US-5254655-A Made by hydrosilation of cyclic polysiloxanes and carbon-carbon bond-containing dye HERCULES INCORPORATED (US) 1993-10-19 US disclosed
EP-0554904-A2 Organosilicon polymers, and dyes, exhibiting nonlinear optical response HERCULES INCORPORATED (US) 1993-08-11 EP 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-20260008904-A1 THIOL COMPOUND CBR1, PSMA1, KAT2A ADRA2C 1622/4885ADRA2B 1236/4885ALDH1A1 236/4885

“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.