SCHEMBL14224802

SCHEMBL14224802

CN(C)CCCn1cc(NC(=O)c2ccc(Cl)cc2F)cc1C(=O)Nc1cc(-c2nc3ccccc3[nH]2)n(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
TP53 P04637 1/20 0.41
MLLT1 Q03111 1/20 0.39
NPC1 O15118 2/20 0.38
POLB P06746 2/20 0.38
RAB9A P51151 2/20 0.38
KLF5 Q13887 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NR2E3 Q9Y5X4 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPK1 P28482 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CTNNB1 P35222 1/20 0.36
TCF7L2 Q9NQB0 1/20 0.36
CYP11B2 P19099 1/20 0.36

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
SCHEMBL14224552 0.93 SMN1; SMN2 (0.43) MAPTTP53NPC1POLBRAB9A
SCHEMBL14224675 0.92 MAPT (0.43) MAPTTP53MLLT1NPC1POLB
SCHEMBL14224801 0.92 CYP11B2 (0.39) MAPTTP53MLLT1NPC1RAB9A
SCHEMBL14224539 0.91 NPC1 (0.43) MAPTTP53NPC1POLBRAB9A
SCHEMBL14224798 0.90 CYP11B2 (0.40) MLLT1NPC1RAB9ACTNNB1TCF7L2
SCHEMBL14224793 0.87 CYP11B2 (0.36) MLLT1MAPK1CTNNB1TCF7L2CYP11B2
SCHEMBL14224529 0.86 FOXO1 (0.41) MAPTTP53NPC1RAB9ASMN1; SMN2
SCHEMBL14224803 0.85 FPR1 (0.42) MAPTTP53NPC1POLBRAB9A
SCHEMBL14224524 0.84 MAPT (0.37) MAPTTP53NPC1POLBRAB9A
SCHEMBL14224550 0.84 HDAC1 (0.34) MAPTTP53MLLT1POLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080090816-A1 ANTI-INFECTIVE BIARYL COMPOUNDS GENESOFT PHARMACEUTICALS, INC. (US) 2008-04-17 US disclosed
US-7265129-B2 Anti-infective biaryl compounds GENESOFT PHARMACEUTICALS, INC. (US) 2007-09-04 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-20080090816-A1 ANTI-INFECTIVE BIARYL COMPOUNDS QTRT1, Q6ZSR9, QTRT2 MAPT 4305/4885TP53 3455/4885MLLT1 837/4885

“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.