SCHEMBL9989116

SCHEMBL9989116

Cn1ccc(NC(=O)c2ccc3c[nH]nc3c2)n1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.60
RAB9A P51151 4/20 0.60
HPGDS O60760 1/20 0.54
RPS6KA3 P51812 1/20 0.50
RPS6KA2 Q15349 1/20 0.50
GRM5 P41594 3/20 0.48
ACSS2 Q9NR19 2/20 0.48
MAPK1 P28482 1/20 0.45
MAPK7 Q13164 1/20 0.44
RET P07949 1/20 0.43
KDR P35968 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NOTUM Q6P988 1/20 0.43
GCK P35557 2/20 0.42
KCNH2 Q12809 1/20 0.42

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
SCHEMBL9991288 0.81 NPC1 (0.60) NPC1RAB9AHPGDSRPS6KA3RPS6KA2
SCHEMBL9989122 0.76 PLK1 (0.48) HPGDSHTTSMN1; SMN2
SCHEMBL9991291 0.76 NPC1 (0.33) NPC1RAB9AHPGDSMAPK1ALDH1A1
SCHEMBL21590291 0.74 NPC1 (0.75) NPC1RAB9AHPGDSMAPK1MAPK7
SCHEMBL22490239 0.74 NPC1 (0.66) NPC1RAB9AHPGDSRPS6KA3RPS6KA2
SCHEMBL25402169 0.74 HDAC6 (0.46)
SCHEMBL17112019 0.74 RAB9A (0.56) NPC1RAB9AMAPK1KDM4EALDH1A1
SCHEMBL27061741 0.73 TP53 (0.47) NPC1RAB9AHPGDSRETKDM4E
SCHEMBL25753506 0.72 MAPT (0.50) NPC1RAB9AHPGDSKDRALDH1A1
SCHEMBL2667078 0.72 NPC1 (0.66) NPC1RAB9AHPGDSRPS6KA3RPS6KA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110319379-A1 Substituted Indazole Amides And Their Use As Glucokinase Activators CORBETT JEFFREY W (US) 2011-12-29 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-20110319379-A1 Substituted Indazole Amides And Their Use As Glucokinase Activators GCKR, GCK, GALK1 NPC1 2208/4885RAB9A 1995/4885HPGDS 3551/4885

“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.