SCHEMBL8247643

SCHEMBL8247643

CC(C)CN(C)C(=O)COc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.65
RAB9A P51151 3/20 0.65
NPC1 O15118 2/20 0.65
MAPK1 P28482 2/20 0.55
PRMT5 O14744 1/20 0.53
WDR77 Q9BQA1 1/20 0.53
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
ALDH1A1 P00352 2/20 0.50
POLB P06746 1/20 0.50
ALOX15 P16050 1/20 0.50
KDM4E B2RXH2 2/20 0.48
ALOX5 P09917 1/20 0.48
HTT P42858 1/20 0.48
MLYCD O95822 2/20 0.47
MAPT P10636 1/20 0.46
TSHR P16473 1/20 0.46

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
SCHEMBL8251092 0.86 TRPM8 (0.56) SMN1; SMN2RAB9ANPC1MAPK1KMT2A
SCHEMBL8251101 0.84 TDP1 (0.58) SMN1; SMN2RAB9ANPC1MAPK1MEN1
SCHEMBL8248874 0.80 NOTUM (0.52) SMN1; SMN2MEN1KMT2AALDH1A1MAPT
SCHEMBL3632818 0.79 SMN1; SMN2 (0.86) SMN1; SMN2RAB9ANPC1MAPK1MEN1
SCHEMBL8241794 0.78 SMN1; SMN2 (0.57) SMN1; SMN2RAB9ANPC1MAPK1MEN1
SCHEMBL7748496 0.77 RAB9A (0.65) SMN1; SMN2RAB9ANPC1MAPK1PRMT5
SCHEMBL27308957 0.77 ATM (0.49) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL8428018 0.75 RAB9A (0.61) SMN1; SMN2RAB9ANPC1MAPK1MEN1
SCHEMBL5696786 0.75 MLYCD (0.69) SMN1; SMN2RAB9ANPC1MAPK1MEN1
SCHEMBL4842036 0.75 SMN1; SMN2 (0.63) SMN1; SMN2RAB9ANPC1MAPK1MEN1

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-7504431-B2 Sulfonyl amide inhibitors of calcium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2009-03-17 US disclosed
US-7504431-B2 Sulfonyl amide inhibitors of calcium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2009-03-17 US disclosed
US-20050245535-A1 Sulfonyl amide inhibitors of calcium channel function BRISTOL- MYERS SQUIBB COMPANY 2005-11-03 US disclosed
US-20050245535-A1 Sulfonyl amide inhibitors of calcium channel function BRISTOL- MYERS SQUIBB COMPANY 2005-11-03 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-20050245535-A1 Sulfonyl amide inhibitors of calcium channel function CACNA1F, CACNA1A, CACNA1D SMN1; SMN2 2190/4885RAB9A 1214/4885NPC1 941/4885

“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.