SCHEMBL29322677

SCHEMBL29322677

O=COCN1C(=O)c2ccc3c4c(ccc(c24)C1=O)C(=O)N(CC(=O)O)C3=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
KDM4E B2RXH2 2/20 0.53
MEN1 O00255 2/20 0.53
ALDH1A1 P00352 2/20 0.53
CYP1A2 P05177 1/20 0.53
MAPT P10636 1/20 0.53
AKR1B1 P15121 1/20 0.53
HPGD P15428 1/20 0.53
ALOX15 P16050 1/20 0.53
HSD17B10 Q99714 1/20 0.53
CA12 O43570 1/20 0.51
CA9 Q16790 1/20 0.51
TDP1 Q9NUW8 2/20 0.50
PIN1 Q13526 1/20 0.48
PIN4 Q9Y237 1/20 0.48
LPAR3 Q9UBY5 2/20 0.45
LPAR1 Q92633 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.40
RGS12 O14924 1/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL13249175 0.94 KMT2A (0.48) KMT2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL860250 0.83 CA12 (0.70) KMT2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL13148744 0.77 KDM4E (0.62) KMT2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL29322688 0.76 KMT2A (0.60) KMT2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL16601837 0.74 CA12 (0.43) KMT2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL12225929 0.74 TERT (0.43) KMT2AKDM4EMEN1ALDH1A1PIN1
SCHEMBL9596654 0.73 CA12 (0.46) KMT2AMEN1ALDH1A1MAPTHSD17B10
SCHEMBL25121968 0.73 KDM4E (0.57) KMT2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL22140317 0.70 MEN1 (0.53) KMT2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL12606551 0.70 KDM4E (0.56) KMT2AKDM4EMEN1ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240243327-A1 NAPHTHALENE DIIMIDE COMPOUND AND REDOX FLOW BATTERY CONTAINING THE SAME KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2024-07-18 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-20240243327-A1 NAPHTHALENE DIIMIDE COMPOUND AND REDOX FLOW BATTERY CONTAINING THE SAME IDH2, NDUFV2, NDUFS8 KMT2A 2360/4885KDM4E 2124/4885MEN1 3399/4885

“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.