SCHEMBL31033013

SCHEMBL31033013

CCNC(=O)Nc1cc(C(=O)OCC)no1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HSP90AA1 P07900 1/20 0.43
HSP90AB1 P08238 1/20 0.43
MAPT P10636 3/20 0.43
TP53 P04637 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 6/20 0.42
HPGD P15428 3/20 0.42
KDM4E B2RXH2 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ACR P10323 1/20 0.41
THRB P10828 1/20 0.41
CYP1A2 P05177 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
GAA P10253 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
SCHEMBL892677 0.78 SCD (0.48) MEN1KMT2AMAPTTP53SMN1; SMN2
SCHEMBL31032840 0.75 MAPK14 (0.43) MEN1KMT2AHSP90AA1HSP90AB1MAPT
SCHEMBL11568178 0.74 ALDH1A1 (0.47) MEN1KMT2AMAPTTP53SMN1; SMN2
SCHEMBL31032976 0.74 MAPK14 (0.44) MEN1KMT2AHSP90AA1MAPTSMN1; SMN2
SCHEMBL15121199 0.74 ALDH1A1 (0.70) ALDH1A1
SCHEMBL892581 0.73 MAPT (0.50) MEN1KMT2AMAPTTP53SMN1; SMN2
SCHEMBL434805 0.73 MEN1 (0.61) MEN1KMT2AMAPTTP53SMN1; SMN2
SCHEMBL1090847 0.72 THRB (0.59) MEN1KMT2AMAPTTP53SMN1; SMN2
SCHEMBL162619 0.72 CYP1A2 (0.50) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL31286841 0.72 CYP1A2 (0.50) MEN1KMT2AMAPTALDH1A1ACR

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-20240343710-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF 1CBIO, INC. 2024-10-17 US disclosed
WO-2024178127-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF 1CBIO, INC. (US) 2024-08-29 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-20240343710-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF PARP1, PARP11, PARP12 MEN1 2494/4885KMT2A 1465/4885HSP90AA1 2878/4885

“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.