SCHEMBL893345

SCHEMBL893345

CCc1ccccc1NCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.60
HDAC8 Q9BY41 1/20 0.56
HPGD P15428 2/20 0.50
KDM4E B2RXH2 1/20 0.50
TSHR P16473 1/20 0.50
GAA P10253 1/20 0.49
BACE1 P56817 1/20 0.47
GRM2 Q14416 1/20 0.47
ABCB1 P08183 2/20 0.46
ABCG2 Q9UNQ0 1/20 0.46
HTT P42858 1/20 0.46
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
TP53 P04637 1/20 0.44
IDO1 P14902 1/20 0.44
ADRA2C P18825 1/20 0.44

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
SCHEMBL19495506 0.93 HSD17B10 (0.53) HSD17B10HDAC8HPGDKDM4ETSHR
SCHEMBL23220940 0.85 HSD17B10 (0.44) HSD17B10HDAC8HPGDKDM4EGAA
Fluoride SCHEMBL28344212 0.84 HSD17B10 (0.51) HSD17B10HDAC8HPGDKDM4ETSHR
SCHEMBL20257645 0.83 ABCB1 (0.50) HSD17B10HDAC8HPGDKDM4ETSHR
SCHEMBL27907603 0.83 ABCB1 (0.54) KDM4ETSHRGAAGRM2ABCB1
Fluoride SCHEMBL8673411 0.83 HSD17B10 (0.50) HSD17B10HDAC8HPGDKDM4ETSHR
SCHEMBL5790165 0.82 HSD17B10 (0.57) HSD17B10HPGDKDM4ETSHRBACE1
Fluoride SCHEMBL5604279 0.81 HSD17B10 (0.49) HSD17B10HDAC8HPGDKDM4ETSHR
SCHEMBL29437254 0.81 CRHR1 (0.54) KDM4EALDH1A1
SCHEMBL27907655 0.81 ABCB1 (0.59) HDAC8KDM4EGRM2ABCB1ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190225889-A1 METHOD TO EXTRACT BITUMEN FROM OIL SANDS USING AROMATIC AMINES DOW GLOBAL TECHNOLOGIES LLC (US) 2019-07-25 US claimed
WO-2018111342-A1 AMINE COMPOSITION FOR STEAM EXTRACTION OF BITUMEN DOW GLOBAL TECHNOLOGIES LLC (US) 2018-06-21 WO claimed
WO-2018017221-A1 METHOD TO EXTRACT BITUMEN FROM OIL SANDS USING AROMATIC AMINES DOW GLOBAL TECHNOLOGIES LLC (US) 2018-01-25 WO claimed
US-9090736-B2 Rheological agent for radiation-curable coating compositions BASF SE (DE) 2015-07-28 US claimed
EP-2678364-B1 RHEOLOGICAL AGENT FOR RADIATION-CURABLE COATING MATERIALS BASF SE (DE) 2015-04-08 EP claimed
WO-2012113739-A1 RHEOLOGICAL AGENT FOR RADIATION-CURABLE COATING MATERIALS BASF SE (DE) 2012-08-30 WO claimed
US-20120214894-A1 RHEOLOGICAL AGENT FOR RADIATION-CURABLE COATING COMPOSITIONS BASF SE (DE) 2012-08-23 US claimed
US-4357342-A 1-Azabicyclo[3.2.0]heptan-3,7-dione-2-carboxylic acid MERCK & CO., INC. (US) 1982-11-02 US claimed
EP-4682141-A1 TRICYCLIC COMPOUND ONO Pharmaceutical Co., Ltd. (JP) 2026-01-21 EP disclosed
US-20250188023-A1 BENZENE DERIVATIVE ONO PHARMACEUTICAL CO., LTD. (JP) 2025-06-12 US disclosed
US-12258308-B2 Benzene derivative ONO PHARMACEUTICAL CO., LTD. (JP) 2025-03-25 US disclosed
CN-119118850-A Method for preparing amino phenethyl alcohol compound by reforming indole compound structure 中国科学院兰州化学物理研究所 2024-12-13 CN disclosed
US-20240327342-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY ONO PHARMACEUTICAL CO., LTD. (JP) 2024-10-03 US disclosed
EP-4431157-A2 1-[[(3S)-3-METHYL-6-(4(4,4-TRIFLUOROBUTOXY)-3,4-DIHYDRONAPHTHALEN-2YL]METHYL]AZETIDINE-3-CARBOXYLIC ACID HAVING S1P5 RECEPTOR AGONIST ACTIVITY FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS AND CANCER ONO Pharmaceutical Co., Ltd. (JP) 2024-09-18 EP disclosed
US-4424230-A CARBAPENICILLIN ANTIBIOTICS MERCK & CO., INC. (US) 1984-01-03 US disclosed
EP-0071395-A1 Beta-lactam antibacterial agents BEECHAM GROUP PLC (GB) 1983-02-09 EP disclosed
US-4369187-A AMINO ACID DERIVATIVE ANTIBIOTICS MERCK & CO., INC. (US) 1983-01-18 US disclosed
US-4357342-A 1-Azabicyclo[3.2.0]heptan-3,7-dione-2-carboxylic acid MERCK & CO., INC. (US) 1982-11-02 US disclosed
EP-0055062-A1 Compounds containing beta-lactams BEECHAM GROUP PLC (GB) 1982-06-30 EP disclosed
US-4310538-A BACTERICIDES MERCK & CO., INC. (US) 1982-01-12 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 (4 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-12258308-B2 Benzene derivative PMP22, TMBIM6, MYT1 HSD17B10 3696/4885HDAC8 2892/4885HPGD 1684/4885
US-20240327342-A1 COMPOUNDS HAVING S1P5 RECEPTOR AGONISTIC ACTIVITY S1PR5, S1PR1, S1PR4 HSD17B10 2211/4885HDAC8 2079/4885HPGD 2591/4885
US-20250188023-A1 BENZENE DERIVATIVE PMP22, TMBIM6, MYT1 HSD17B10 3766/4885HDAC8 2796/4885HPGD 1732/4885
US-20120214894-A1 RHEOLOGICAL AGENT FOR RADIATION-CURABLE COATING COMPOSITIONS RAD51, XRCC6, XRCC5 HSD17B10 4576/4885HDAC8 851/4885HPGD 2770/4885

“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.