SCHEMBL4890845

SCHEMBL4890845

CC1CNCCC1c1ccc2c(c1)CCCC2

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 1/20 0.36
P2RY14 Q15391 1/20 0.35
HTR2A P28223 6/20 0.35
HTR2C P28335 6/20 0.35
HTR2B P41595 5/20 0.35
ADRA2A P08913 2/20 0.35
ADRB1 P08588 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
CNR1 P21554 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
HRH1 P35367 1/20 0.35
KCNH2 Q12809 1/20 0.35
REN P00797 1/20 0.33
PDE4B Q07343 1/20 0.33

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
SCHEMBL4890839 1.00 HTR3A (0.36) HTR3AP2RY14HTR2AHTR2CHTR2B
SCHEMBL4890857 1.00 HTR3A (0.36) HTR3AP2RY14HTR2AHTR2CHTR2B
SCHEMBL6042587 0.82 TLR9 (0.41) HTR3AREN
SCHEMBL1363874 0.79 HTR3A (0.53) HTR3AHTR2AHTR2BHTR1ASLC6A2
SCHEMBL4886195 0.77 PRKCI (0.36) P2RY14HTR2AHTR2BHTR1AADRA2C
SCHEMBL4886181 0.77 PRKCI (0.36) P2RY14HTR2AHTR2BHTR1AADRA2C
SCHEMBL4886190 0.77 PRKCI (0.36) P2RY14HTR2AHTR2BHTR1AADRA2C
SCHEMBL26513787 0.76 HTR2C (0.41) HTR3AP2RY14HTR2AHTR2CHTR2B
SCHEMBL19702118 0.75 KDM1A (0.51)
SCHEMBL21404000 0.75 KDM1A (0.51)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312271-A1 AZABENZIMIDAZOLYL COMPOUNDS PFIZER INC. 2008-12-18 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-20080312271-A1 AZABENZIMIDAZOLYL COMPOUNDS AZI2, PAICS, UGT2B7 HTR3A 1458/4885P2RY14 1860/4885HTR2A 1378/4885

“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.