SCHEMBL31689136

SCHEMBL31689136

NC(=O)c1ccsc1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 9/20 0.55
PLA2G10 O15496 1/20 0.53
PLA2G2A P14555 1/20 0.53
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
ALDH1A1 P00352 7/20 0.48
MAPT P10636 4/20 0.48
HSD17B10 Q99714 3/20 0.48
USP2 O75604 2/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
RECQL P46063 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
MAPK1 P28482 1/20 0.47
LMNA P02545 2/20 0.45
GLA P06280 1/20 0.45
MAPK10 P53779 3/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL11394536 0.87 HNF4A (0.47) MAPK8PLA2G10PLA2G2ANPC1RAB9A
SCHEMBL13147514 0.85 NPC1 (0.58) MAPK8PLA2G10PLA2G2ANPC1RAB9A
SCHEMBL27491958 0.79 ALDH1A1 (0.46) MAPK8NPC1RAB9AALDH1A1MAPT
Benzene SCHEMBL28714317 0.77 ALDH1A1 (0.52) MAPK8PLA2G10PLA2G2ANPC1RAB9A
SCHEMBL4673936 0.76 PTPN1 (0.38) MAPK8PLA2G10PLA2G2ANPC1RAB9A
SCHEMBL6162448 0.74 MAPK8 (0.47) MAPK8NPC1RAB9AALDH1A1MAPT
Formic Acid SCHEMBL28199033 0.74 NPC1 (0.52) MAPK8NPC1RAB9AALDH1A1MAPT
SCHEMBL15468336 0.74 ALDH1A1 (0.53) MAPK8NPC1RAB9AALDH1A1MAPT
SCHEMBL13147505 0.74 LTB4R (0.50) MAPK8NPC1RAB9ASMN1; SMN2
SCHEMBL30979860 0.72 MAPK8 (0.54) MAPK8PLA2G10PLA2G2ANPC1RAB9A

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-20250295652-A1 Inhibitors of Molluscum Contagiosum Infection and Methods Using the Same UNIV PENNSYLVANIA (US) 2025-09-25 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-20250295652-A1 Inhibitors of Molluscum Contagiosum Infection and Methods Using the Same ITCH, EIF2AK2, TBK1 MAPK8 1733/4885PLA2G10 3147/4885PLA2G2A 3521/4885

“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.