SCHEMBL14747477

SCHEMBL14747477

CCOC(=O)c1c(-c2ccccc2)n[nH]c1NC(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.52
SMN1; SMN2 Q16637 6/20 0.51
NPC1 O15118 6/20 0.51
RAB9A P51151 5/20 0.51
GAA P10253 2/20 0.51
TSHR P16473 4/20 0.49
KDM4E B2RXH2 4/20 0.49
ALDH1A1 P00352 4/20 0.49
LMNA P02545 3/20 0.49
ADORA3 P0DMS8 3/20 0.49
HTT P42858 1/20 0.48
MAPT P10636 4/20 0.47
POLB P06746 2/20 0.47
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47
HPGD P15428 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
ALOX12 P18054 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
SCHEMBL12997994 0.82 RAB9A (0.57) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
SCHEMBL11269746 0.79 HPGDS (0.61) HPGDSSMN1; SMN2NPC1RAB9AGAA
SCHEMBL13054047 0.79 RAB9A (0.57) SMN1; SMN2NPC1RAB9AKDM4EALDH1A1
SCHEMBL1969117 0.77 HPGDS (0.59) HPGDSSMN1; SMN2NPC1RAB9AGAA
SCHEMBL13901726 0.77 ALDH1A1 (0.57) SMN1; SMN2NPC1RAB9AGAATSHR
SCHEMBL3263722 0.76 HPGDS (0.57) HPGDSSMN1; SMN2NPC1RAB9AGAA
SCHEMBL14747500 0.75 ALDH1A1 (0.52) SMN1; SMN2NPC1RAB9AGAATSHR
SCHEMBL17279852 0.75 HPGDS (0.60) HPGDSSMN1; SMN2NPC1RAB9AGAA
SCHEMBL10924593 0.75 HPGDS (0.56) HPGDSSMN1; SMN2NPC1RAB9AGAA
SCHEMBL8287820 0.74 BCHE (0.54) SMN1; SMN2NPC1RAB9AGAATSHR

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-20130123265-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2013-05-16 US disclosed
US-8389567-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2013-03-05 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-20130123265-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, ATP2A1 HPGDS 395/4885SMN1; SMN2 732/4885NPC1 211/4885

“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.