SCHEMBL5772726

SCHEMBL5772726

CC(C)(C)OC(=O)NCc1ccc2c(n1)CCN(Cc1ccccc1)C2

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 1/20 0.48
GAA P10253 1/20 0.48
MAPK1 P28482 1/20 0.48
NPFFR1 Q9GZQ6 1/20 0.46
NPFFR2 Q9Y5X5 1/20 0.46
MAPT P10636 8/20 0.46
TP53 P04637 8/20 0.46
MEN1 O00255 1/20 0.45
DRD2 P14416 2/20 0.45
POLB P06746 1/20 0.44
NAMPT P43490 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
SCHEMBL5772682 0.76 KMT2A (0.51) ALDH1A1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL7041028 0.76 NAMPT (0.55) SMN1; SMN2KMT2AKDM4ENPFFR1NPFFR2
SCHEMBL16217190 0.76 MEN1 (0.59) NPC1RAB9AKMT2AGAAMAPT
SCHEMBL10209789 0.75 NPC1 (0.52) ALDH1A1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL2907874 0.74 KMT2A (0.54) ALDH1A1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL31647939 0.74 NPC1 (0.52) ALDH1A1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL29995938 0.74 NPFFR1 (0.49) ALDH1A1SMN1; SMN2KMT2ANPFFR1NPFFR2
Hydrochloric Acid SCHEMBL720333 0.74 NPC1 (0.51) ALDH1A1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL5776892 0.74 MEN1 (0.59) SMN1; SMN2NPC1RAB9AKMT2AMAPT
SCHEMBL16264685 0.73 KMT2A (0.55) ALDH1A1SMN1; SMN2NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1483257-B1 QUINAZOLINE COMPOUNDS USEFUL IN THERAPY PFIZER LTD (GB) 2006-09-13 EP disclosed
US-6936619-B2 Cardiovascular disorders; antilipemic agents; sexual disorders PFIZER, INC. (US) 2005-08-30 US disclosed
US-20040029859-A1 Compounds useful in therapy PFIZER INC. 2004-02-12 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-20040029859-A1 Compounds useful in therapy ADRA1D, HSD3B1, PTGER1 ALDH1A1 1113/4885SMN1; SMN2 3472/4885NPC1 468/4885

“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.