SCHEMBL9898774

SCHEMBL9898774

Cc1nnc(-c2ccc(Oc3cc(OC(C)C4CC4)cc(C(=O)Nc4ncc(C)s4)c3)cc2)o1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
ALDH1A1 P00352 1/20 0.43
GCK P35557 12/20 0.42
PAX8 Q06710 1/20 0.40
MAPK14 Q16539 1/20 0.40
P2RX3 P56373 1/20 0.39
P2RX2 Q9UBL9 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
KCNH2 Q12809 1/20 0.38
PKM P14618 1/20 0.38

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
SCHEMBL9899573 0.87 GCK (0.58) GCKKCNH2
SCHEMBL9897078 0.86 GCK (0.53) GCKKCNH2
SCHEMBL9898059 0.86 GCK (0.53) GCKKCNH2
SCHEMBL9899890 0.86 NPC1 (0.49) NPC1RAB9ASMN1; SMN2ALDH1A1GCK
SCHEMBL9898829 0.85 GCK (0.59) NPC1RAB9ASMN1; SMN2GCK
SCHEMBL9898647 0.84 NPC1 (0.49) NPC1RAB9ASMN1; SMN2ALDH1A1GCK
SCHEMBL10317517 0.83 SMN1; SMN2 (0.39) NPC1RAB9ASMN1; SMN2ALDH1A1GCK
SCHEMBL9898826 0.83 P2RX3 (0.51) NPC1RAB9ASMN1; SMN2ALDH1A1P2RX3
SCHEMBL9897876 0.82 GCK (0.40) NPC1RAB9ASMN1; SMN2ALDH1A1GCK
SCHEMBL10317278 0.82 SMN1; SMN2 (0.40) NPC1RAB9ASMN1; SMN2ALDH1A1GCK

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-8450494-B2 Disubstituted benzamide derivatives as glucokinase (GK) activators CADILA HEALTHCARE LIMITED (IN) 2013-05-28 US disclosed
US-20120149704-A1 DISUBSTITUTED BENZAMIDE DERIVATIVES AS GLUCOKINASE (GK) ACTIVATORS CADILA HEALTHCARE LIMITED (IN) 2012-06-14 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-20120149704-A1 DISUBSTITUTED BENZAMIDE DERIVATIVES AS GLUCOKINASE (GK) ACTIVATORS GCKR, GCK, GK NPC1 1754/4885RAB9A 3593/4885SMN1; SMN2 3730/4885

“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.