SCHEMBL3929360

SCHEMBL3929360

CC(=O)Nc1cc(Br)cc(C(=O)c2cccnc2)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.51
HTT P42858 3/20 0.51
KMT2A Q03164 2/20 0.51
HPGD P15428 1/20 0.51
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
TDP1 Q9NUW8 1/20 0.49
ALDH1A1 P00352 3/20 0.48
BDKRB1 P46663 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
POLB P06746 1/20 0.46
GRM5 P41594 1/20 0.46
ALOX15 P16050 1/20 0.44
LMNA P02545 1/20 0.44
HIF1A Q16665 1/20 0.44
GAA P10253 1/20 0.44
MEN1 O00255 1/20 0.44

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
SCHEMBL3932777 0.87 TSHR (0.57) MAPTKMT2AHPGDRAB9ANPC1
SCHEMBL3927937 0.87 ALDH1A1 (0.49) MAPTHTTKMT2ARAB9ANPC1
SCHEMBL3926257 0.86 RAB9A (0.47) MAPTHTTKMT2ARAB9ANPC1
SCHEMBL9002580 0.83 HTT (0.63) MAPTHTTKMT2AHPGDRAB9A
SCHEMBL3925229 0.83 LMNA (0.51) MAPTHTTKMT2ARAB9AALDH1A1
SCHEMBL3937219 0.83 HTT (0.57) MAPTHTTKMT2ARAB9ANPC1
SCHEMBL3930503 0.82 NAMPT (0.49) MAPTHTTKMT2ARAB9ANPC1
SCHEMBL9002078 0.81 TRPA1 (0.57) MAPTHTTKMT2AHPGDTDP1
SCHEMBL6325974 0.80 ALDH1A1 (0.68) MAPTHTTKMT2AHPGDRAB9A
SCHEMBL3937581 0.78 CYP11B1 (0.49) MAPTHTTKMT2AHPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090093479-A1 ANTI-CANCER AGENTS AND USES THEREOF LOCUS PHARMACEUTICALS, INC. (US) 2009-04-09 US claimed
US-20080280891-A1 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. (US) 2008-11-13 US claimed
WO-2008008059-A1 ANTI-CANCER AGENTS ANS USES THEREOF LOCUS PHARMACEUTICALS, INC. (US) 2008-01-17 WO claimed
US-20090093479-A1 ANTI-CANCER AGENTS AND USES THEREOF LOCUS PHARMACEUTICALS, INC. (US) 2009-04-09 US disclosed
US-7504401-B2 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. (US) 2009-03-17 US disclosed
US-20080280891-A1 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. (US) 2008-11-13 US disclosed
WO-2008008059-A1 ANTI-CANCER AGENTS ANS USES THEREOF LOCUS PHARMACEUTICALS, INC. (US) 2008-01-17 WO disclosed
US-20060270686-A1 Anti-cancer agents and uses thereof LOCUS PHARMACEUTICALS, INC. 2006-11-30 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 (3 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-20090093479-A1 ANTI-CANCER AGENTS AND USES THEREOF H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, MCL1, CBR3 MAPT 4855/4885HTT 3972/4885KMT2A 2531/4885
US-20060270686-A1 Anti-cancer agents and uses thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, MCL1, CBR3 MAPT 4850/4885HTT 3953/4885KMT2A 2491/4885
US-20080280891-A1 Anti-cancer agents and uses thereof NR2E3, RB1, CBR3 MAPT 3741/4885HTT 2987/4885KMT2A 3984/4885

“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.