Pyridine

Pyridine

SCHEMBL6100271

C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.[Cl-].[Cl-].[Ru+2]=Cc1ccccc1.c1ccncc1

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Pyridine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.33
CYP11B2 P19099 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
POLB P06746 2/20 0.33
GAA P10253 1/20 0.33
CYP11B1 P15538 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
HSP90AA1 P07900 2/20 0.31
MAPK1 P28482 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
CYP1A2 P05177 2/20 0.30
MEN1 O00255 2/20 0.30
CYP2D6 P10635 2/20 0.30
CYP2C19 P33261 2/20 0.30
KMT2A Q03164 2/20 0.30
GRM5 P41594 1/20 0.30
CHRNB2 P17787 1/20 0.30

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
Hydrochloric Acid SCHEMBL175377 0.92 POLB (0.37) SMN1; SMN2ALDH1A1TRPM8POLBGAA
Hydrochloric Acid SCHEMBL2064723 0.92 POLB (0.37) SMN1; SMN2ALDH1A1TRPM8POLBGAA
Hydrochloric Acid SCHEMBL4119676 0.90 POLB (0.38) SMN1; SMN2ALDH1A1TRPM8POLBGAA
Iodide SCHEMBL2464728 0.89 POLB (0.37) SMN1; SMN2ALDH1A1TRPM8POLBGAA
Bromide SCHEMBL2467102 0.89 POLB (0.37) SMN1; SMN2ALDH1A1TRPM8POLBGAA
Hydrochloric Acid SCHEMBL4542337 0.75 POLB (0.37) SMN1; SMN2ALDH1A1TRPM8POLBGAA
Pyridine SCHEMBL18210482 0.74 TSHR (0.36) CYP11B2
Hydrochloric Acid SCHEMBL4446695 0.74 POLB (0.34) SMN1; SMN2TRPM8POLBGAAHSP90AA1
SCHEMBL3276196 0.73 GAA (0.38) SMN1; SMN2ALDH1A1TRPM8POLBGAA
SCHEMBL2868301 0.73 GAA (0.38) SMN1; SMN2ALDH1A1TRPM8POLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7084222-B2 Ruthenium complexes, process for preparation thereof, and processes for producing open-ring polymer of cycloolefins and hydrogenation products thereof by using the complex as catalyst ZEON CORPORATION (JP) 2006-08-01 US disclosed
US-20050014916-A1 Ruthenium complexes, process for preparation thereof, and processes for producing open-ring polymer of cycloolefins and hydrogenation products thereof by using the complex as catalyst ZEON CORPORATION (JP) 2005-01-20 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-20050014916-A1 Ruthenium complexes, process for preparation thereof, and processes for producing open-ring polymer of cycloolefins and hydrogenation products thereof by using the complex as catalyst POR, CAD, HRH1 SMN1; SMN2 4578/4885CYP11B2 114/4885ALDH1A1 3138/4885

“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.