SCHEMBL13626622

SCHEMBL13626622

Cc1ccccc1NC(=O)c1cscn1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.59
NPC1 O15118 3/20 0.55
RAB9A P51151 3/20 0.55
HPGD P15428 3/20 0.53
POLB P06746 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.51
GRM4 Q14833 2/20 0.49
IRAK4 Q9NWZ3 1/20 0.49
HTT P42858 3/20 0.49
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.49
MAPK1 P28482 1/20 0.49
HSD17B10 Q99714 1/20 0.49
KDM4C Q9H3R0 1/20 0.49
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
GRM1 Q13255 1/20 0.47
GAA P10253 1/20 0.47

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
Ammonia Solution, Strong SCHEMBL27976383 0.98 PIM1 (0.57) PIM1NPC1RAB9AHPGDPOLB
SCHEMBL6287453 0.82 HDAC1 (0.68) PIM1GRM4ALDH1A1MAPK1GRM1
SCHEMBL26627433 0.82 PIM1 (0.59) PIM1NPC1RAB9ASMN1; SMN2GRM4
SCHEMBL12666639 0.81 PIM1 (0.55) PIM1NPC1RAB9AGRM4HTT
SCHEMBL29531380 0.81 NPC1 (0.79) NPC1RAB9AHPGDPOLBSMN1; SMN2
SCHEMBL12437777 0.81 NPC1 (0.79) NPC1RAB9AHPGDPOLBSMN1; SMN2
SCHEMBL25381987 0.80 MAPT (0.55) PIM1SMN1; SMN2GRM4HSD17B10KMT2A
SCHEMBL16866331 0.80 DHODH (0.49) PIM1NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL26627416 0.79 L3MBTL1 (0.56) NPC1RAB9AHPGDSMN1; SMN2HTT
SCHEMBL19476138 0.79 ALDH1A1 (0.63) PIM1HPGDPOLBGRM4IRAK4

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-20130203770-A1 CARBAMOYL DERIVATIVES OF BICYCLIC CARBONYLAMINO-PYRAZOLES AS PRODRUGS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-08-08 US disclosed
WO-2009138440-A1 CARBAMOYL DERIVATIVES OF BICYCLIC CARBONYLAMINO-PYRAZOLES AS PRODRUGS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2009-11-19 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 (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-20130203770-A1 CARBAMOYL DERIVATIVES OF BICYCLIC CARBONYLAMINO-PYRAZOLES AS PRODRUGS DMPK, DCK, MAP3K19 PIM1 128/4885NPC1 2320/4885RAB9A 1562/4885

“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.