SCHEMBL6638468

SCHEMBL6638468

c1cc2sccc2c(C2CCNCC2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.52
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
JAK2 O60674 2/20 0.34
JAK1 P23458 2/20 0.34
TYK2 P29597 1/20 0.34
JAK3 P52333 1/20 0.34
ADRB2 P07550 1/20 0.33
SLC18A3 Q16572 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
MKNK1 Q9BUB5 2/20 0.33
MKNK2 Q9HBH9 2/20 0.33
ROCK2 O75116 1/20 0.33
ROCK1 Q13464 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
HTR1A P08908 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32

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
SCHEMBL6644012 0.75 HTR2C (0.40) HTR2CNPC1RAB9ADRD2HTR2A
SCHEMBL6642596 0.72 HTT (0.49) MEN1KMT2AJAK2JAK1TYK2
SCHEMBL30735496 0.71 HTR2C (0.50) HTR2CMEN1KMT2AADRB2SLC18A3
SCHEMBL6595004 0.71 HTR2C (0.47) HTR2CADRB2HTR1ASLC6A2SLC6A4
SCHEMBL6275687 0.71 HTR2C (0.50) HTR2CMEN1KMT2AADRB2SLC18A3
SCHEMBL6637094 0.70 HTR2C (0.51) HTR2CJAK2JAK1TYK2JAK3
SCHEMBL6639009 0.70 JAK2 (0.46) HTR2CJAK2JAK1TYK2JAK3
SCHEMBL7600035 0.69 CHRM4 (0.50) MEN1KMT2ACHRM2
SCHEMBL616087 0.69 HTR2C (1.00) HTR2C
SCHEMBL4142576 0.68 MKNK1 (0.42) HTR2CMEN1KMT2AJAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5247052-A None JP disclosed
EP-1078928-B1 Pyridine derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2004-05-12 EP disclosed
US-6486171-B2 USEFUL IN THE TREATMENT OF SOME CENTRAL NERVOUS SYSTEM DISORDERS INCLUDING AS AN ANTIDEPRESSANT; 4-(1-(2-NAPHTHYL)ETHYL)-4- PIPERIDINYL)THIENO(3,2-C)PYRIDINE, FOR EXAMPLE LES LABORATOIRES SERVIER (FR) 2002-11-26 US disclosed
US-20020161228-A1 Piperidine compounds ADIR ET COMPAGNIE 2002-10-31 US disclosed
US-6399616-B1 4-(4-(2-(5-(1,2,4-TRIAZOL-1-YLMETHYL)-1H-INDOL-3-YL)ETHYL)-1 -PIPERAZINYL)FURO(3,2-C)PYRIDINE; COMBINED SEROTONIN REUPTAKE INHIBITOR AND PARTIAL AGONIST OF 5-HT RECEPTORS; REDUCED LATENCY; DEPRESSION LES LABORATOIRES SERVIER (FR) 2002-06-04 US disclosed
EP-1078928-A1 Pyridine derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2001-02-28 EP disclosed
JP-H05247052-A 4-(4-PIPERIDINYL)-THIENO-(3,2-C)PYRIDINE DERIVATIVE OF N-ALKYL-GULTALIMIDE BRISTOL MYERS SQUIBB CO 1993-09-24 JP disclosed
EP-0545421-A1 4-(4-piperidinyl-thieno(3,2-c)pyridine derivatives of N-alkylglutarimides as antipsychotic agents Bristol-Myers Squibb Company (US) 1993-06-09 EP disclosed
US-5137894-A Psychological disorders BRISTOL-MYERS SQUIBB COMPANY A CORPORATION OF DELAWARE 1992-08-11 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 (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-20020161228-A1 Piperidine compounds OTC, NPPA, AQP4 HTR2C 1212/4885MEN1 977/4885KMT2A 916/4885

“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.