SCHEMBL3290538

SCHEMBL3290538

O=C1C=CC(=O)C(c2c(Br)ccc3c2ccc2cc(Br)ccc23)=C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR6 P51684 1/20 0.37
HKDC1 Q2TB90 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
HSD17B3 P37058 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
MAPK1 P28482 2/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
ALOX12 P18054 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
ERN1 O75460 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
SCHEMBL7905047 0.84 ALDH1A1 (0.53) CCR6HKDC1MAOAMAOBHSD17B3
SCHEMBL28031782 0.76 HKDC1 (0.50) CCR6HKDC1MAOAMAOBHSD17B3
SCHEMBL7918755 0.71 MEN1 (0.35) CCR6HKDC1MAOAMAOBHSD17B3
SCHEMBL3759127 0.71 PTPN11 (0.40) MAOAMAOBHSD17B3MEN1KMT2A
SCHEMBL29094064 0.70 CCR6 (0.66) CCR6HKDC1MAOAMAOBHSD17B3
SCHEMBL646886 0.70 CYP2A6 (0.55) MEN1KMT2AALDH1A1CYP1A2CYP2C19
SCHEMBL12260028 0.70 CYP2A6 (0.55) MEN1KMT2AALDH1A1CYP1A2CYP2C19
SCHEMBL28225186 0.69 MAOA (0.55) CCR6HKDC1MAOAMAOBHSD17B3
SCHEMBL28583375 0.69 MAPT (0.47) HKDC1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL9350253 0.68 NR1I2 (0.44) CCR6HKDC1MAOAMAOBMEN1

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117447682-A Porous conjugated microporous polymer and preparation method and application thereof 赣南师范大学 2024-01-26 CN claimed
CN-116143798-B Diphenylamine organic matter based on phenanthrenequinone derivative 云南大学 2023-07-14 CN claimed
CN-116143798-A Diphenylamine organic matter based on phenanthrenequinone derivative 云南大学 2023-05-23 CN claimed
CN-114031565-A N, N' -disubstituted dihydrophenazine-based compound and preparation method and application thereof 华东理工大学 2022-02-11 CN claimed
CN-117447682-A Porous conjugated microporous polymer and preparation method and application thereof 赣南师范大学 2024-01-26 CN disclosed
CN-116143798-B Diphenylamine organic matter based on phenanthrenequinone derivative 云南大学 2023-07-14 CN disclosed
CN-116143798-B Diphenylamine organic matter based on phenanthrenequinone derivative 云南大学 2023-07-14 CN disclosed
CN-116143798-A Diphenylamine organic matter based on phenanthrenequinone derivative 云南大学 2023-05-23 CN disclosed
CN-116143798-A Diphenylamine organic matter based on phenanthrenequinone derivative 云南大学 2023-05-23 CN disclosed
CN-116120527-A Near-infrared conjugated polymer and preparation method and application thereof 南京邮电大学 2023-05-16 CN disclosed
CN-115850194-A Vibration-induced luminescent compound and preparation method and application thereof 华东理工大学 2023-03-28 CN disclosed
CN-109599504-B Novel compound and organic electroluminescent device using same 北京鼎材科技有限公司 2022-02-18 CN disclosed
US-6277519-B1 QUENCHING AN ALLOY MELT; COMMINUTION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-08-21 US disclosed
US-6096144-A TREATING WITH ACIDIC OR ALKALINE SOLUTION OF CONJUGATED UNSATURATED COMPOUND WITH AT LEAST 5 BONDS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-08-01 US disclosed
US-5858571-A TREATING A PULVERIZED HYDROGEN ABSORBING ALLOY WITH A SOLUTION COMPRISING A CONJUGATED UNSATURATED COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-01-12 US disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
EP-0172427-B1 PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER Shin-Etsu Chemical Co., Ltd. (JP) 1989-07-05 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP disclosed