SCHEMBL5353363

SCHEMBL5353363

O=C(NCCc1ccccc1F)C1(c2ccccc2)CCCCC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.63
HTT P42858 1/20 0.63
LMNA P02545 3/20 0.54
NPSR1 Q6W5P4 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
HDAC4 P56524 3/20 0.54
ERCC1 P07992 1/20 0.51
ERCC4 Q92889 1/20 0.51
TSHR P16473 1/20 0.50
CHRM2 P08172 1/20 0.49
CHRM5 P08912 1/20 0.48
CHRM3 P20309 1/20 0.48
OPRL1 P41146 1/20 0.47
AKR1C1 Q04828 1/20 0.45
P2RX7 Q99572 1/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
CNR1 P21554 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
SCHEMBL5355981 0.93 SMN1; SMN2 (0.53) SMN1; SMN2HTTLMNANPSR1L3MBTL1
SCHEMBL5348970 0.90 SMN1; SMN2 (0.51) SMN1; SMN2HTTLMNANPSR1L3MBTL1
SCHEMBL5345980 0.90 CNR1 (0.55) SMN1; SMN2HTTLMNANPSR1L3MBTL1
SCHEMBL5356509 0.89 SMN1; SMN2 (0.50) SMN1; SMN2HTTLMNANPSR1L3MBTL1
SCHEMBL5357953 0.88 HDAC4 (0.59) SMN1; SMN2HTTLMNAHDAC4OPRL1
SCHEMBL2497408 0.79 CHRM5 (0.51) CHRM5CHRM3OPRL1KMT2AMEN1
SCHEMBL5350234 0.78 SMN1; SMN2 (0.64) SMN1; SMN2HTTLMNANPSR1L3MBTL1
SCHEMBL10253166 0.78 CHRM5 (0.50) SMN1; SMN2HTTCHRM5CHRM3OPRL1
SCHEMBL5350274 0.78 CHRM5 (0.77) SMN1; SMN2HTTLMNANPSR1L3MBTL1
SCHEMBL14491525 0.77 SMN1; SMN2 (0.68) SMN1; SMN2HTTLMNANPSR1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2007-06-21 US disclosed
US-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2007-06-21 US disclosed
US-7202253-B2 Cycloalkyl inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-10 US disclosed
US-7202253-B2 Cycloalkyl inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-10 US disclosed
US-7202253-B2 Cycloalkyl inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-10 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-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION KCNJ2, KCNN3, KCNQ5 SMN1; SMN2 4281/4885HTT 1708/4885LMNA 1535/4885

“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.