SCHEMBL20715420

SCHEMBL20715420

FC(F)(F)Oc1cccc(Cn2c(N3CCCCC3)nc3ccccc32)c1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 5/20 0.52
SOS1 Q07889 1/20 0.48
CYP2D6 P10635 6/20 0.46
HRH1 P35367 6/20 0.46
CHRM1 P11229 2/20 0.46
KCNH2 Q12809 3/20 0.45
MCHR1 Q99705 1/20 0.45
GALR2 O43603 1/20 0.44
GALR1 P47211 1/20 0.44

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
SCHEMBL20715421 0.99 HTR3A (0.53) HTR3ASOS1CYP2D6HRH1CHRM1
SCHEMBL22726492 0.90 MCHR1 (0.50) HTR3ASOS1CYP2D6HRH1CHRM1
SCHEMBL20715696 0.82 HRH1 (0.43) HTR3ACYP2D6HRH1CHRM1KCNH2
SCHEMBL7341277 0.80 HTR3A (0.75) HTR3ACYP2D6HRH1CHRM1KCNH2
SCHEMBL23361862 0.80 CSF1R (0.57) SOS1CYP2D6
SCHEMBL4083456 0.80 PPARG (0.47) MCHR1
SCHEMBL20919806 0.77 HRH1 (0.54) HTR3ACYP2D6HRH1CHRM1KCNH2
SCHEMBL20919807 0.77 HRH1 (0.54) HTR3ACYP2D6HRH1CHRM1KCNH2
SCHEMBL22726431 0.75 MCHR1 (0.55) CYP2D6MCHR1
SCHEMBL20715427 0.74 CYP2D6 (0.64) HTR3ASOS1CYP2D6HRH1CHRM1

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-20200377505-A1 BENZIMIDAZOLES AND AZA-BENZIMIDAZOLES, AND METHODS OF USE THEREOF GFB (ABC), LLC 2020-12-03 US disclosed
WO-2019028308-A1 BENZIMIDAZOLES AND AZA-BENZIMIDAZOLES, AND METHODS OF USE THEREOF GOLDFINCH BIO, INC. (US) 2019-02-07 WO 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-20200377505-A1 BENZIMIDAZOLES AND AZA-BENZIMIDAZOLES, AND METHODS OF USE THEREOF AZI2, ATP6V1B1, GLS HTR3A 2446/4885SOS1 4682/4885CYP2D6 154/4885

“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.