SCHEMBL12562465

SCHEMBL12562465

CC(=O)c1sc2nc3ccccc3cc2c1N

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC14A1 Q13336 1/20 0.71
MAPT P10636 7/20 0.51
KMT2A Q03164 5/20 0.51
RAB9A P51151 5/20 0.51
SMN1; SMN2 Q16637 5/20 0.51
MEN1 O00255 4/20 0.51
KDM4E B2RXH2 4/20 0.51
HPGD P15428 4/20 0.51
ALDH1A1 P00352 4/20 0.51
MCL1 Q07820 2/20 0.51
NPC1 O15118 4/20 0.50
POLB P06746 2/20 0.50
THRB P10828 1/20 0.50
RECQL P46063 1/20 0.50
BLM P54132 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
TP53 P04637 3/20 0.47
GAA P10253 1/20 0.47
ALOX15 P16050 1/20 0.47
HSD17B10 Q99714 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
SCHEMBL11001442 0.87 NPC1 (0.57) SLC14A1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL29912577 0.87 NPC1 (0.57) SLC14A1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL16372920 0.77 MAPT (0.63) MAPTKMT2ARAB9ASMN1; SMN2MEN1
SCHEMBL12562446 0.75 SLC14A1 (0.60) SLC14A1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL12562427 0.73 LIMK1 (0.77) SLC14A1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL19769162 0.72 SLC14A1 (0.81) SLC14A1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL13954996 0.70 MAPT (0.47) MAPTKMT2ARAB9AMEN1KDM4E
SCHEMBL9541407 0.70 ALDH1A1 (0.50) SLC14A1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL19769233 0.70 NPC1 (0.70) SLC14A1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL10632495 0.70 MAPT (0.61) SLC14A1MAPTKMT2ARAB9ASMN1; SMN2

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-20110152301-A1 Compounds that Inhibit HIV Particle Formation UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2011-06-23 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-20110152301-A1 Compounds that Inhibit HIV Particle Formation REV1, VPS51, FLOT1 SLC14A1 4599/4885MAPT 1501/4885KMT2A 4150/4885

“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.