SCHEMBL22440685

SCHEMBL22440685

CN(C)c1ccc(/N=N/c2ccc(C(=O)Nc3ccc(NC(=O)c4ccc(NC(=O)c5ccc(NC(=O)CC(C)(C)C)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.50
KDM4E B2RXH2 4/20 0.50
RAB9A P51151 4/20 0.50
ALDH1A1 P00352 3/20 0.50
MCL1 Q07820 2/20 0.50
HSD17B10 Q99714 2/20 0.50
LMNA P02545 2/20 0.50
TP53 P04637 2/20 0.50
TSHR P16473 1/20 0.50
NPC1 O15118 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
MAPK1 P28482 1/20 0.49
POLB P06746 1/20 0.49
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NAMPT P43490 2/20 0.46
KCNK3 O14649 1/20 0.46
HPGD P15428 2/20 0.46

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
SCHEMBL22440687 1.00 MAPT (0.50) MAPTKDM4ERAB9AALDH1A1MCL1
SCHEMBL22440674 0.92 MAPT (0.57) MAPTKDM4ERAB9AALDH1A1MCL1
SCHEMBL22461367 0.81 NAMPT (0.54) MAPTKDM4ERAB9AALDH1A1MCL1
SCHEMBL10892514 0.80 KCNK3 (0.65) MAPTKDM4ERAB9AALDH1A1MCL1
SCHEMBL10892520 0.80 KCNK3 (0.65) MAPTKDM4ERAB9AALDH1A1MCL1
SCHEMBL19935503 0.78 RAB9A (0.65) MAPTKDM4ERAB9AALDH1A1MCL1
SCHEMBL19930182 0.78 RAB9A (0.65) MAPTKDM4ERAB9AALDH1A1MCL1
SCHEMBL22440671 0.77 RAB9A (0.60) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL22440670 0.77 RAB9A (0.60) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL22440676 0.77 RAB9A (0.60) MAPTRAB9ANPC1MEN1KMT2A

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-20200298194-A1 ARAMID AMPHIPHILE SELF-ASSEMBLED NANOSTRUCTURES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2020-09-24 US disclosed
WO-2020191329-A1 ARAMID AMPHIPHILE SELF-ASSEMBLED NANOSTRUCTURES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2020-09-24 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-20200298194-A1 ARAMID AMPHIPHILE SELF-ASSEMBLED NANOSTRUCTURES ANXA6, ANXA1, ANXA11 MAPT 1447/4885KDM4E 4448/4885RAB9A 1478/4885

“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.