SCHEMBL3961891

SCHEMBL3961891

Fc1ccccc1-c1ccc(N2CC=CCC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.42
NPSR1 Q6W5P4 1/20 0.37
DGAT1 O75907 1/20 0.37
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAP4K1 Q92918 1/20 0.36
LMNA P02545 1/20 0.36
PTPRC P08575 1/20 0.36
PTPN1 P18031 1/20 0.36
HTR7 P34969 2/20 0.36
FPR2 P25090 1/20 0.36
CNR2 P34972 2/20 0.35
MAPKAPK2 P49137 1/20 0.35
HTR1A P08908 1/20 0.35
HTR2B P41595 1/20 0.35
HTR3A P46098 1/20 0.35
HTR6 P50406 1/20 0.35
GRM2 Q14416 1/20 0.35
AR P10275 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
SCHEMBL3899588 0.79 USP2 (0.42) ALDH1A1IKBKB
SCHEMBL3892797 0.78 ALDH1A1 (0.49) NPSR1MAPTALDH1A1L3MBTL1HTR3A
SCHEMBL4565389 0.77 MAPK1 (0.48) NPSR1MAPTALDH1A1LMNA
Hydrochloric Acid SCHEMBL6368616 0.75 MAPK1 (0.47) NPSR1MAPTALDH1A1LMNA
SCHEMBL6650889 0.75 HTR7 (0.58) ALDH1A1HTR7MAPKAPK2HTR1AHTR2B
SCHEMBL1889513 0.74 LMNA (0.46) MAPTALDH1A1L3MBTL1LMNAHTR1A
SCHEMBL27478933 0.73 FFAR4 (0.43) DHODHNPSR1MAPTALDH1A1L3MBTL1
SCHEMBL3961892 0.73 TAAR1 (0.46) DHODHALDH1A1PTPN1HTR7HTR1A
SCHEMBL24045702 0.73 DGAT1 (0.44) DHODHNPSR1DGAT1MAPTALDH1A1
Hydrochloric Acid SCHEMBL27925724 0.73 LMNA (0.45) MAPTALDH1A1L3MBTL1LMNAHTR1A

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
US-7498344-B2 Arylpiperidinol and arylpiperidine derivatives and pharmaceuticals containing the same ASUBIO PHARMA CO., LTD. (JP) 2009-03-03 US disclosed
EP-0867183-B1 ARYLPIPERIDINOL AND ARYLPIPERIDINE DERIVATIVES AND DRUGS CONTAINING THE SAME DAIICHI SUNTORY PHARMA CO LTD (JP) 2004-10-06 EP disclosed
US-20040186138-A1 Arylpiperidinol and arylpiperidine derivatives and pharmaceuticals containing the same DAIICHI SUNTORY PHARMA CO., LTD. 2004-09-23 US disclosed
US-6706734-B2 ANTIISCHEMIC AGENTS; ANTICONVULSANTS; HEADACHES DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2004-03-16 US disclosed
US-20030130312-A1 Arylpiperidinol and arylpiperidine derivatives and pharmaceuticals containing the same ASUBIO PHARMA CO., LTD. (JP) 2003-07-10 US disclosed
US-6455549-B1 ANTIEPILEPTIC, ANTIISCHEMIC, AND ANTIMIGRAINE AGENTS; CALCIUM OVELOAD SUPPRESSANTS SUNTORY LIMITED (JP) 2002-09-24 US disclosed
EP-0867183-A1 ARYLPIPERIDINOL AND ARYLPIPERIDINE DERIVATIVES AND DRUGS CONTAINING THE SAME SUNTORY LIMITED (JP) 1998-09-30 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 (2 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-20030130312-A1 Arylpiperidinol and arylpiperidine derivatives and pharmaceuticals containing the same KCNH1, KCNH2, NPY1R DHODH 1333/4885NPSR1 321/4885DGAT1 3636/4885
US-20040186138-A1 Arylpiperidinol and arylpiperidine derivatives and pharmaceuticals containing the same KCNH1, KCNH2, NPY1R DHODH 1333/4885NPSR1 321/4885DGAT1 3636/4885

“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.