SCHEMBL13924639

SCHEMBL13924639

C=C(C)C(=O)NCCC[N+](C)(C)CC(=O)NCCN1C(=O)NC(C)(C)C1=O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.38
▸ FPR2 P25090 1/20 0.35
▸ POLB P06746 1/20 0.33
▸ APOBEC3A P31941 1/20 0.33
▸ APOBEC3G Q9HC16 1/20 0.33
▸ PADI4 Q9UM07 1/20 0.33
▸ ALDH1A1 P00352 6/20 0.32
▸ TSHR P16473 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ LMNA P02545 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ HTT P42858 1/20 0.30

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
SCHEMBL13924638 0.84 KMT2A (0.47) KMT2AFPR2POLBAPOBEC3AAPOBEC3G
SCHEMBL14443972 0.74 KMT2A (0.45) KMT2APOLBALDH1A1TDP1SMN1; SMN2
SCHEMBL29990375 0.73 CBLB (0.36) KMT2A
SCHEMBL10755881 0.71 KMT2A (0.50) KMT2AFPR2POLBAPOBEC3AAPOBEC3G
SCHEMBL13845448 0.71 KDM4E (0.45) TSHRLMNA
SCHEMBL12646807 0.71 KMT2A (0.53) KMT2AFPR2POLBPADI4ALDH1A1
SCHEMBL21783321 0.71 CBLB (0.43) KMT2AMAPK1HTT
SCHEMBL23375507 0.69 CBLB (0.42) KMT2AMAPK1HTT
SCHEMBL18327380 0.69 CBLB (0.42) KMT2AMAPK1HTT
SCHEMBL19458462 0.69 CBLB (0.42) KMT2AMAPK1HTT

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-7488830-B2 Imidazolidine-2,4-dione monomers, useful in making hydantoin polymers RHODIA INC. (US) 2009-02-10 — — US disclosed
US-20070025946-A1 Polymers having heterocyclic substituent groups, monomers useful in making such polymers, and compositions containing such polymers RHODIA OPERATIONS (FR) 2007-02-01 — — 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-20070025946-A1 Polymers having heterocyclic substituent groups, monomers useful in making such polymers, and compositions containing such polymers MMS19, MRPS9, UNC119 KMT2A 3138/4885FPR2 696/4885POLB 502/4885

“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.

Send feedback