SCHEMBL7202685

SCHEMBL7202685

Brc1cccc(-c2cnc3ccccc3n2)c1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.66
RAB9A P51151 9/20 0.66
BIRC5 O15392 1/20 0.61
JAK2 O60674 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
TP53 P04637 1/20 0.54
STAT1 P42224 1/20 0.54
JAK3 P52333 4/20 0.53
BCHE P06276 1/20 0.53
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
MITF O75030 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
HTT P42858 1/20 0.50
TLR9 Q9NR96 1/20 0.49

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
SCHEMBL30180823 0.83 NPC1 (0.58) NPC1RAB9ABIRC5SMN1; SMN2TP53
SCHEMBL15111910 0.82 NPC1 (0.70) NPC1RAB9AJAK2SMN1; SMN2TP53
SCHEMBL22661773 0.81 NPC1 (0.68) NPC1RAB9AJAK2SMN1; SMN2TP53
SCHEMBL973317 0.80 NPC1 (0.68) NPC1RAB9ASMN1; SMN2BCHEKMT2A
SCHEMBL30786723 0.80 NPC1 (0.68) NPC1RAB9ASMN1; SMN2BCHEKMT2A
SCHEMBL5225670 0.79 NPC1 (0.60) NPC1RAB9ASMN1; SMN2BCHEALDH1A1
SCHEMBL3024116 0.79 BCHE (0.67) NPC1RAB9AJAK2SMN1; SMN2TP53
SCHEMBL1464105 0.79 NPC1 (1.00) NPC1RAB9AJAK2SMN1; SMN2TP53
SCHEMBL15112605 0.79 BCHE (0.68) NPC1RAB9AJAK2SMN1; SMN2TP53
SCHEMBL28389822 0.79 BCHE (0.68) NPC1RAB9AJAK2SMN1; SMN2TP53

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106458934-A Quinoxaline compounds and uses thereof 米伦纽姆医药公司 2017-02-22 CN disclosed
CN-102656163-A Heterocyclic compounds for the inhibition of PASK BIOENERGENIX 2012-09-05 CN disclosed
US-6605615-B2 Administering to a patient suffering from hypercholesterolemia, hyperlipedimea and other metabolic disorders an effective amount of hydrozone, oxime or imine derivatives TULARIK INC. 2003-08-12 US disclosed
US-20010056096-A1 Hydrazones and analogs as cholesterol lowering agents AMGEN INC. 2001-12-27 US disclosed
WO-2001064646-A2 HYDRAZONES AND ANALOGS AS CHOLESTEROL LOWERING AGENTS TULARIK INC. (US) 2001-09-07 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-20010056096-A1 Hydrazones and analogs as cholesterol lowering agents LDLR, HDLBP, SREBF1 NPC1 9/4885RAB9A 3049/4885BIRC5 2343/4885

“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.