SCHEMBL8280432

SCHEMBL8280432

Cc1ccc(-n2c(C(=O)Nc3ccc(F)cc3)cnc2S)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
RAB9A P51151 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
NPC1 O15118 3/20 0.46
ALDH1A1 P00352 2/20 0.46
GAA P10253 2/20 0.46
ADORA3 P0DMS8 1/20 0.45
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
GRM5 P41594 2/20 0.45
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
RECQL P46063 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL14248834 0.76 TDP1 (0.48) SMN1; SMN2ALDH1A1ADORA3ADORA2AADORA1
SCHEMBL4036279 0.74 SMN1; SMN2 (0.37) RAB9ASMN1; SMN2NPC1ALDH1A1GRM5
SCHEMBL14249281 0.73 POLB (0.47) RAB9ANPC1ALDH1A1GAAMEN1
SCHEMBL8279472 0.72 AURKA (0.47) SMN1; SMN2ALDH1A1GAAMEN1KMT2A
SCHEMBL14248954 0.71 GRM5 (0.34) RAB9ASMN1; SMN2NPC1ALDH1A1ADORA3
SCHEMBL3830999 0.71 PTGS2 (0.52) RAB9ASMN1; SMN2NPC1ALDH1A1GAA
SCHEMBL4035995 0.70 IDO1 (0.49) RAB9ASMN1; SMN2NPC1ALDH1A1GAA
SCHEMBL21096059 0.70 SMN1; SMN2 (0.70) RAB9ASMN1; SMN2NPC1ALDH1A1GAA
SCHEMBL4036284 0.69 SMN1; SMN2 (0.36) SMN1; SMN2ALDH1A1GAAADORA3ADORA2A
SCHEMBL8279471 0.69 CYP2C19 (0.33) CNR1RAB9ASMN1; SMN2ALDH1A1ADORA3

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-20070281937-A1 Ion Channel Modulators SCION PHARMACEUTICALS, INC. 2007-12-06 US disclosed
US-20070281937-A1 Ion Channel Modulators SCION PHARMACEUTICALS, INC. 2007-12-06 US disclosed
US-20070208064-A1 Ion channel modulators WYETH (US) 2007-09-06 US disclosed
US-20070208064-A1 Ion channel modulators WYETH (US) 2007-09-06 US disclosed
WO-2005087228-A1 ION CHANNEL MODULATORS WYETH (US) 2005-09-22 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 (2 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-20070281937-A1 Ion Channel Modulators CACNA1B, CACNA1C, TRPV1 CNR1 293/4885CNR2 255/4885RAB9A 1595/4885
US-20070208064-A1 Ion channel modulators CACNA1B, CACNA1C, TRPV1 CNR1 293/4885CNR2 255/4885RAB9A 1595/4885

“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.