SCHEMBL23958379

SCHEMBL23958379

c1ccc(CN2CCCN(Cc3nc(-c4ccccc4)no3)CC2)cc1

nearest known ligand 0.92

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.92
KCNH2 Q12809 2/20 0.92
LMNA P02545 5/20 0.77
ALDH1A1 P00352 4/20 0.77
SMN1; SMN2 Q16637 3/20 0.77
MAPT P10636 3/20 0.77
TSHR P16473 1/20 0.77
HSD17B10 Q99714 1/20 0.77
MAPK1 P28482 3/20 0.67
HTT P42858 2/20 0.65
NPSR1 Q6W5P4 1/20 0.65
NPC1 O15118 3/20 0.65
RAB9A P51151 3/20 0.65
POLB P06746 1/20 0.65
CYP1A2 P05177 1/20 0.64
CYP2C19 P33261 1/20 0.64
KMT2A Q03164 3/20 0.62
L3MBTL1 Q9Y468 3/20 0.62
MEN1 O00255 2/20 0.62
CASP1 P29466 1/20 0.62

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
SCHEMBL27324835 0.81 KCNH2 (0.72) CYP2D6KCNH2LMNAALDH1A1SMN1; SMN2
SCHEMBL17100583 0.80 CYP2D6 (0.71) CYP2D6KCNH2LMNAALDH1A1SMN1; SMN2
SCHEMBL18134606 0.78 CYP2D6 (1.00) CYP2D6KCNH2LMNAALDH1A1SMN1; SMN2
SCHEMBL26632300 0.78 MAPK1 (0.68) CYP2D6KCNH2LMNAALDH1A1SMN1; SMN2
SCHEMBL23958389 0.78 KCNH2 (0.57) CYP2D6KCNH2LMNAALDH1A1SMN1; SMN2
SCHEMBL576379 0.75 SIGMAR1 (0.86) LMNAPOLBKMT2A
SCHEMBL1043563 0.75 SIGMAR1 (0.86) LMNAPOLBKMT2A
SCHEMBL1044952 0.75 SIGMAR1 (0.86) LMNAPOLBKMT2A
SCHEMBL577331 0.75 SIGMAR1 (0.86) LMNAPOLBKMT2A
SCHEMBL3427885 0.75 RAB9A (1.00) CYP2D6KCNH2LMNAALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230355597-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT AND PREVENTION OF AVIAN PATHOGENIC E. COLI (APEC) OHIO STATE INNOVATION FOUNDATION 2023-11-09 US disclosed
US-11660294-B2 Compounds, compositions, and methods for the treatment and prevention of avian pathogenic E. coli (APEC) OHIO STATE INNOVATION FOUNDATION (US) 2023-05-30 US disclosed
US-11660294-B2 Compounds, compositions, and methods for the treatment and prevention of avian pathogenic E. coli (APEC) OHIO STATE INNOVATION FOUNDATION (US) 2023-05-30 US disclosed
US-20210330655-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT AND PREVENTION OF AVIAN PATHOGENIC E. COLI (APEC) OHIO STATE INNOVATION FOUNDATION 2021-10-28 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 (3 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-20230355597-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT AND PREVENTION OF AVIAN PATHOGENIC E. COLI (APEC) FABP2, APC, AP1G1 CYP2D6 4733/4885KCNH2 4471/4885LMNA 866/4885
US-11660294-B2 Compounds, compositions, and methods for the treatment and prevention of avian pathogenic E. coli (APEC) FABP2, APC, AP1G1 CYP2D6 4733/4885KCNH2 4471/4885LMNA 866/4885
US-20210330655-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT AND PREVENTION OF AVIAN PATHOGENIC E. COLI (APEC) FABP2, APC, AP1G1 CYP2D6 4733/4885KCNH2 4471/4885LMNA 866/4885

“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.