SCHEMBL668551

SCHEMBL668551

[c]1ccc(CCCc2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.54
SIGMAR1 Q99720 3/20 0.50
MAOA P21397 1/20 0.50
MAOB P27338 2/20 0.48
IDO1 P14902 1/20 0.46
HDAC3 O15379 1/20 0.46
MAPK1 P28482 1/20 0.46
ADRA1A P35348 1/20 0.46
HDAC4 P56524 1/20 0.46
SLC6A3 Q01959 1/20 0.46
HDAC1 Q13547 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46

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
SCHEMBL919897 0.95 MAOA (0.56) HTR2ASIGMAR1MAOAMAOBL3MBTL1
SCHEMBL687989 0.93 SIGMAR1 (0.56) SIGMAR1MAOAMAOBL3MBTL1
SCHEMBL8939756 0.93 SIGMAR1 (0.56) SIGMAR1MAOAMAOBL3MBTL1
SCHEMBL158694 0.90 MAOA (0.50) HTR2ASIGMAR1MAOAMAOBSMN1; SMN2
SCHEMBL9863991 0.87 MAOB (0.54) HTR2AMAOAMAOBHDAC1SMN1; SMN2
SCHEMBL27498097 0.87 MAOA (0.48) HTR2ASIGMAR1MAOAMAOBSMN1; SMN2
SCHEMBL11803736 0.84 MAOA (0.40) HTR2ASIGMAR1MAOAMAOBSLC6A3
SCHEMBL54347 0.84 HTR2A (0.70) HTR2ASIGMAR1MAOAMAOBIDO1
SCHEMBL11690401 0.81 SIGMAR1 (0.41) HTR2ASIGMAR1MAOAMAOBSLC6A3
SCHEMBL9069707 0.81 HTR2A (0.75) HTR2ASIGMAR1MAOAMAOBIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240025884-A1 COMPOUNDS AS GCN2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF DONG-A ST CO., LTD. (KR) 2024-01-25 US claimed
WO-2024009215-A1 NOVEL COMPOUNDS AS GCN2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF DONG-A ST CO., LTD. (KR) 2024-01-11 WO claimed
US-20180033965-A1 NOVEL DIAMINE COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME E-RAY OPTOELECTRONICS TECHNOLOGY CO., LTD. (TW) 2018-02-01 US claimed
CN-103221047-A Compounds and methods TEMPERO PHARMACEUTICALS INC 2013-07-24 CN claimed
WO-2008104756-A1 UREA DERIVATIVES AND THEIR THERAPEUTIC USE SERENTIS LIMITED (GB) 2008-09-04 WO claimed
US-11997917-B2 Quantum dot electroluminescence device SAMSUNG ELECTRONICS CO., LTD. (KR) 2024-05-28 US disclosed
US-20240114765-A1 QUANTUM DOT ELECTROLUMINESCENCE DEVICE SAMSUNG ELECTRONICS CO LTD (KR) 2024-04-04 US disclosed
US-20240025884-A1 COMPOUNDS AS GCN2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF DONG-A ST CO., LTD. (KR) 2024-01-25 US disclosed
WO-2024009215-A1 NOVEL COMPOUNDS AS GCN2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF DONG-A ST CO., LTD. (KR) 2024-01-11 WO disclosed
EP-3751631-B1 POLYMER MATERIAL, MATERIAL FOR ELECTROLUMINESCENCE DEVICE, LIQUID COMPOSITION, THIN FILM, AND ELECTROLUMINESCENCE DEVICE SAMSUNG ELECTRONICS CO LTD (KR) 2023-12-13 EP disclosed
US-11758800-B2 Polymer material, material for electroluminescence device, liquid composition, thin film, and electroluminescence device SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-09-12 US disclosed
US-20230139979-A1 ORGANIC AMINE COLLECTION METHOD ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-05-04 US disclosed
WO-1998013355-A1 HETEROCYCLIC ESTERS AND AMIDES GUILFORD PHARMACEUTICALS INC. (US) 1998-04-02 WO disclosed
EP-0805796-A1 CELL ADHESION INHIBITORS BIOGEN, INC. (US) 1997-11-12 EP disclosed
WO-1997016190-A1 ROTAMASE ENZYME ACTIVITY INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1997-05-09 WO disclosed
WO-1996022966-A1 CELL ADHESION INHIBITORS BIOGEN, INC. (US) 1996-08-01 WO disclosed
EP-0514332-B1 Bis-phosphites CIBA GEIGY AG (CH) 1996-04-17 EP disclosed
US-5308902-A Heterocyclic fused ring structures, stabilizers for PVC and polyolefins CIBA-GEIGY CORPORATION (US) 1994-05-03 US disclosed
EP-0514332-A1 Bis-phosphites CIBA-GEIGY AG (CH) 1992-11-19 EP disclosed
EP-0058740-B1 IMPROVED POLYESTER MOLDING COMPOSITIONS AND MOLDED ARTICLES PRODUCED THEREFROM UNION CARBIDE CORPORATION (US) 1985-05-22 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 (3 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-20180033965-A1 NOVEL DIAMINE COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME OR10J3, AOC1, SAT1 HTR2A 2906/4885SIGMAR1 1100/4885MAOA 877/4885
US-20230139979-A1 ORGANIC AMINE COLLECTION METHOD H1-0, F12, C1S HTR2A 1639/4885SIGMAR1 1054/4885MAOA 89/4885
US-20240025884-A1 COMPOUNDS AS GCN2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF EIF2AK4, GCN1, GCGR HTR2A 2687/4885SIGMAR1 3330/4885MAOA 2614/4885

“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.