SCHEMBL6000413

SCHEMBL6000413

CCn1ccc2c(C)c(Oc3cc(Cl)c(F)cc3CCN)ccc21

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 7/20 0.37
SLC6A4 P31645 2/20 0.37
KCNH2 Q12809 2/20 0.37
SOS1 Q07889 1/20 0.36
TAAR1 Q96RJ0 2/20 0.36
HTR2C P28335 5/20 0.34
ADRA1A P35348 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
HTR2B P41595 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
SCHEMBL6000249 0.89 HTR2A (0.38) HTR2ASLC6A4KCNH2SOS1TAAR1
SCHEMBL6000407 0.87 SLC6A4 (0.52) HTR2ASLC6A4KCNH2
SCHEMBL5497118 0.79 ADRB2 (0.38) HTR2ASLC6A4KCNH2SOS1TAAR1
SCHEMBL5502055 0.79 TAAR1 (0.44) HTR2ASLC6A4KCNH2SOS1TAAR1
SCHEMBL6000243 0.76 SLC6A4 (0.54) HTR2ASLC6A4KCNH2
SCHEMBL5503523 0.75 TAAR1 (0.43) HTR2ASLC6A4KCNH2SOS1TAAR1
SCHEMBL5502595 0.75 TAAR1 (0.47) HTR2ASLC6A4KCNH2SOS1TAAR1
SCHEMBL5998621 0.74 RHEB (0.55) HTR2ASLC6A4KCNH2SOS1TAAR1
SCHEMBL5501819 0.74 SOS1 (0.36) HTR2ASLC6A4KCNH2SOS1TAAR1
SCHEMBL5501642 0.73 TAAR1 (0.51) HTR2ATAAR1HTR2CADRA1AHTR2B

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-20060058361-A1 Therapeutic diphenyl ether ligands PFIZER INC 2006-03-16 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-20060058361-A1 Therapeutic diphenyl ether ligands HTR2B, HTR2C, HTR3B HTR2A 7/4885SLC6A4 150/4885KCNH2 2331/4885

“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.