SCHEMBL6760767

SCHEMBL6760767

Cn1c(CNc2ccc3sc(C(=O)NCc4cccnc4)cc3c2)nc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.48
NPC1 O15118 9/20 0.47
RAB9A P51151 9/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
GAA P10253 1/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
LMNA P02545 3/20 0.47
PKM P14618 1/20 0.47
HPGD P15428 1/20 0.47
TSHR P16473 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 3/20 0.45
TP53 P04637 2/20 0.45
ALOX15 P16050 1/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
KDM4E B2RXH2 2/20 0.44
CLK1 P49759 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
SCHEMBL6756370 0.84 NPC1 (0.51) HDAC1NPC1RAB9AL3MBTL1GAA
SCHEMBL6759302 0.77 HRH4 (0.56) NPC1RAB9AL3MBTL1GAASMN1; SMN2
SCHEMBL6758072 0.75 NPC1 (0.48) NPC1RAB9AL3MBTL1GAASMN1; SMN2
SCHEMBL6602659 0.74 HDAC1 (0.52) HDAC1LMNAPKMHPGDTSHR
SCHEMBL6760766 0.74 SLC40A1 (0.43) HDAC1NPC1RAB9AL3MBTL1SMN1; SMN2
SCHEMBL6759320 0.72 HDAC1 (0.52) HDAC1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL6602111 0.72 POLB (0.59) NPC1RAB9AGAASMN1; SMN2LMNA
SCHEMBL6758247 0.71 FNTA (0.59) HDAC1NAMPT
SCHEMBL13494013 0.69 SENP1 (0.58) HDAC1RAB9ASMN1; SMN2LMNAKMT2A
SCHEMBL13494011 0.67 HDAC2 (0.62) HDAC1RAB9ACLK1NAMPT

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-20040204417-A1 Novel benzothienyl or indole derivatives, preparation and use thereof as inhibitors of prenyl transferase proteins PIERRE FABRE MEDICAMENT (FR) 2004-10-14 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-20040204417-A1 Novel benzothienyl or indole derivatives, preparation and use thereof as inhibitors of prenyl transferase proteins CBR1, CBR3, HCCS HDAC1 1120/4885NPC1 416/4885RAB9A 2084/4885

“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.