SCHEMBL15517828

SCHEMBL15517828

N#Cc1cc(Br)ccc1OCC(=O)NN

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.49
GAA P10253 1/20 0.49
AAK1 Q2M2I8 2/20 0.47
MAPK1 P28482 2/20 0.45
TSHR P16473 1/20 0.45
NPC1 O15118 7/20 0.43
RAB9A P51151 6/20 0.43
TP53 P04637 3/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 4/20 0.43
POLB P06746 1/20 0.43
OGG1 O15527 1/20 0.43
HPGD P15428 2/20 0.42
LMNA P02545 2/20 0.42
XDH P47989 1/20 0.42
FHIT P49789 1/20 0.42
KDM4E B2RXH2 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL1849529 0.84 AAK1 (0.47) SMN1; SMN2GAAAAK1MAPK1NPC1
SCHEMBL3499253 0.82 PTGDR2 (0.59) AAK1TSHRPOLBXDH
SCHEMBL15518170 0.82 NPC1 (0.56) SMN1; SMN2GAAAAK1MAPK1TSHR
SCHEMBL31681530 0.78 MEN1 (0.48) SMN1; SMN2GAAAAK1MAPK1TSHR
SCHEMBL15074081 0.77 POLB (0.48) SMN1; SMN2GAAAAK1NPC1RAB9A
SCHEMBL13665142 0.76 RAB9A (0.63) SMN1; SMN2MAPK1TSHRNPC1RAB9A
SCHEMBL13665115 0.76 AAK1 (0.59) SMN1; SMN2GAAAAK1MAPK1TSHR
SCHEMBL30188569 0.76 AAK1 (0.59) SMN1; SMN2GAAAAK1MAPK1TSHR
SCHEMBL13665127 0.74 PTGDR2 (0.55) AAK1TSHRPOLBHPGDXDH
SCHEMBL14820084 0.73 MAOB (0.45) AAK1ALDH1A1HPGDXDHKDM4E

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
EP-2890677-B1 N-ACYLHYDRAZONE DERIVATIVES FOR SELECTIVE T CELL INHIBITOR AND ANTI-LYMPHOID MALIGNANCY DRUG CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2017-11-15 EP disclosed
US-9447083-B2 N-acylhydrazone derivatives for selective T cell inhibitor and anti-lymphoid malignancy drug CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2016-09-20 US disclosed
US-20150252030-A1 N-ACYLHYDRAZONE DERIVATIVES FOR SELECTIVE T CELL INHIBITOR AND ANTI-LYMPHOID MALIGNANCY DRUG CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2015-09-10 US disclosed
EP-2890677-A1 N-ACYLHYDRAZONE DERIVATIVES FOR SELECTIVE T CELL INHIBITOR AND ANTI-LYMPHOID MALIGNANCY DRUG Chong Kun Dang Pharmaceutical Corp. (KR) 2015-07-08 EP disclosed
WO-2014035149-A1 N-ACYLHYDRAZONE DERIVATIVES FOR SELECTIVE T CELL INHIBITOR AND ANTI-LYMPHOID MALIGNANCY DRUG CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2014-03-06 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-20150252030-A1 N-ACYLHYDRAZONE DERIVATIVES FOR SELECTIVE T CELL INHIBITOR AND ANTI-LYMPHOID MALIGNANCY DRUG MALT1, MCL1, ACIN1 SMN1; SMN2 4406/4885GAA 1233/4885AAK1 1952/4885

“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.