SCHEMBL21533484

SCHEMBL21533484

NCCCn1c(CCCOc2ccccc2)nc2cc(Cl)cnc21

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 6/20 0.41
TP53 P04637 4/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
HPGD P15428 1/20 0.41
MAPT P10636 2/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 2/20 0.39
RECQL P46063 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ATM Q13315 1/20 0.39
BRD4 O60885 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL21533486 0.83 APEX1 (0.47) MEN1KMT2ASMN1; SMN2RAB9AMAPT
SCHEMBL21533538 0.74 TLR7 (0.39) MEN1KMT2ASMN1; SMN2TP53RAB9A
SCHEMBL21533487 0.73 HCRTR1 (0.46) MEN1KMT2ASMN1; SMN2TP53RAB9A
SCHEMBL21533488 0.70 APEX1 (0.48) MEN1KMT2ASMN1; SMN2RAB9AHPGD
SCHEMBL3864788 0.70 TLR7 (0.70)
SCHEMBL7689381 0.69 SMN1; SMN2 (0.70) MEN1KMT2ASMN1; SMN2TP53RAB9A
SCHEMBL5349651 0.67 TLR7 (0.75)
SCHEMBL22777773 0.66 TBXA2R (0.43) MEN1KMT2ARAB9ANPC1HPGD
SCHEMBL21533485 0.66 HDAC1 (0.42) MEN1KMT2ASMN1; SMN2TP53RAB9A
SCHEMBL6307635 0.66 EGFR (0.57) MEN1KMT2A

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-20190330167-A1 ACTIVATORS OF HIV LATENCY THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2019-10-31 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-20190330167-A1 ACTIVATORS OF HIV LATENCY NFATC1, EP300, CD69 MEN1 4858/4885KMT2A 535/4885SMN1; SMN2 4829/4885

“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.