SCHEMBL7213367

SCHEMBL7213367

CC1(C)CCCC1CNC(=O)c1ccc(C(=O)NN)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
CA2 P00918 1/20 0.42
MAPT P10636 2/20 0.41
MMP13 P45452 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MLYCD O95822 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
MPO P05164 1/20 0.40
CYP3A4 P08684 1/20 0.40
KDM5A P29375 1/20 0.40
BLM P54132 1/20 0.40
GFER P55789 1/20 0.40
PMP22 Q01453 1/20 0.40
HIF1A Q16665 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL7213350 0.89 KMT2A (0.43) KMT2AMEN1HPGDSMN1; SMN2NPC1
SCHEMBL7218616 0.86 KMT2A (0.47) KMT2AMEN1HPGDSMN1; SMN2NPC1
SCHEMBL7219875 0.85 KMT2A (0.41) KMT2AMEN1HPGDSMN1; SMN2NPC1
SCHEMBL7213373 0.78 MAPK14 (0.36) KMT2AMEN1HPGDSMN1; SMN2NPC1
SCHEMBL7213379 0.74 NPC1 (0.45) KMT2AMEN1HPGDNPC1ALDH1A1
SCHEMBL7218555 0.74 HDAC3 (0.37) SMN1; SMN2HDAC6
SCHEMBL7219299 0.73 MAPK14 (0.37)
SCHEMBL7218637 0.73 DDX3X (0.44) HDAC6
SCHEMBL7213178 0.73 MAPK14 (0.33) SMN1; SMN2
SCHEMBL7219859 0.71 HPGD (0.43) KMT2AMEN1HPGDSMN1; SMN2MAPT

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-6624309-B1 Administering 4-heterocyclicbenzamide derivative BRISTOL-MYERS SQUIBB COMPANY 2003-09-23 US disclosed
US-20020137968-A1 Benzoic acid derivatives and related compounds as antiarrhythmic agents LLOYD JOHN (US) 2002-09-26 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-20020137968-A1 Benzoic acid derivatives and related compounds as antiarrhythmic agents SCN1A, SCN1B, NR0B1 KMT2A 2962/4885MEN1 2374/4885HPGD 732/4885

“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.