SCHEMBL17792131

SCHEMBL17792131

Cc1ccc(C(=O)Nc2ccc(F)c(F)c2)cc1SC1CCC(C)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
LMNA P02545 2/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
BRD4 O60885 1/20 0.45
KCNQ3 O43525 3/20 0.45
KCNQ2 O43526 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAOA P21397 1/20 0.43
MAPT P10636 3/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL17792178 0.91 NPC1 (0.46) MAOBNPC1RAB9ALMNACASP3
SCHEMBL17792127 0.91 NPC1 (0.47) MAOBNPC1RAB9ALMNACASP3
SCHEMBL17792134 0.91 NPC1 (0.49) MAOBNPC1RAB9ALMNACASP3
SCHEMBL17792132 0.90 BRD4 (0.41) NPC1RAB9ALMNAMEN1KMT2A
SCHEMBL17784085 0.90 MAOB (0.50) MAOBNPC1RAB9ALMNACASP3
SCHEMBL17792130 0.88 MAOB (0.46) MAOBNPC1RAB9ALMNACASP3
SCHEMBL19473187 0.86 MEN1 (0.48) MAOBNPC1RAB9ALMNACASP3
SCHEMBL19473196 0.85 KCNQ3 (0.44) MAOBNPC1RAB9ALMNACASP3
SCHEMBL19473184 0.83 TAS1R3 (0.42) MAOBNPC1RAB9ALMNACASP3
SCHEMBL17792118 0.83 NPC1 (0.50) MAOBNPC1RAB9ALMNACASP3

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-20160151375-A1 SULFIDE ALKYL COMPOUNDS FOR HBV TREATMENT NOVIRA THERAPEUTICS, INC. 2016-06-02 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-20160151375-A1 SULFIDE ALKYL COMPOUNDS FOR HBV TREATMENT HAVCR2, HCCS, CBS MAOB 3507/4885NPC1 205/4885RAB9A 3577/4885

“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.