SCHEMBL13626442

SCHEMBL13626442

Cc1ccccc1NC(=O)c1ccsc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.65
POLB P06746 1/20 0.65
NPC1 O15118 3/20 0.55
RAB9A P51151 3/20 0.55
KMT2A Q03164 2/20 0.54
EPHX2 P34913 1/20 0.54
KCNK3 O14649 1/20 0.54
KCNK9 Q9NPC2 1/20 0.54
ALDH1A1 P00352 3/20 0.51
HDAC1 Q13547 1/20 0.51
LMNA P02545 3/20 0.51
HTT P42858 2/20 0.51
KDM4E B2RXH2 1/20 0.51
MAPK1 P28482 1/20 0.51
HSD17B10 Q99714 1/20 0.51
KDM4C Q9H3R0 1/20 0.51
MAPT P10636 2/20 0.50
MEN1 O00255 1/20 0.50
TAS1R3 Q7RTX0 1/20 0.50
TAS1R1 Q7RTX1 1/20 0.50

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
SCHEMBL9055150 0.81 HPGD (0.89) HPGDPOLBNPC1RAB9AKMT2A
SCHEMBL11260761 0.81 HDAC1 (0.65) HPGDNPC1RAB9AEPHX2KCNK3
SCHEMBL12674224 0.80 HPGD (0.56) HPGDNPC1RAB9AKMT2AEPHX2
SCHEMBL12666628 0.80 NPC1 (0.57) HPGDPOLBNPC1RAB9AKMT2A
SCHEMBL2908808 0.79 HPGD (0.79) HPGDPOLBNPC1RAB9AKMT2A
N-O-Tolylbenzamide SCHEMBL3223289 0.79 HPGD (1.00) HPGDPOLBNPC1RAB9AKMT2A
SCHEMBL11787825 0.78 HPGD (0.58) HPGDNPC1RAB9AKMT2AEPHX2
SCHEMBL3690383 0.76 POLB (0.79) HPGDPOLBNPC1RAB9AKMT2A
SCHEMBL6623847 0.76 HPGD (1.00) HPGDNPC1RAB9AKCNK3KCNK9
SCHEMBL6859613 0.75 HPGD (0.77) HPGDPOLBNPC1RAB9AKMT2A

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 HPGD 922/4885POLB 3079/4885NPC1 2320/4885

“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.