SCHEMBL19002813

SCHEMBL19002813

CCCC(=O)Nc1ccc(OC)nc1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.71
KMT2A Q03164 5/20 0.71
KDM4E B2RXH2 2/20 0.71
MAPT P10636 2/20 0.71
LMNA P02545 4/20 0.60
PABPC1 P11940 4/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
NPSR1 Q6W5P4 2/20 0.60
NPC1 O15118 4/20 0.59
PKM P14618 1/20 0.59
ALDH1A1 P00352 2/20 0.57
RAB9A P51151 3/20 0.57
HTT P42858 1/20 0.57
RECQL P46063 1/20 0.56
HSD17B10 Q99714 1/20 0.55
TP53 P04637 2/20 0.55

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
SCHEMBL13263619 0.91 MEN1 (0.68) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL13298957 0.89 MEN1 (0.64) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL19151059 0.88 KMT2A (0.75) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL13233328 0.85 KMT2A (0.68) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL8788394 0.85 KMT2A (0.76) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL23222382 0.84 KMT2A (0.66) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL19110996 0.84 KMT2A (0.66) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL10509419 0.83 KMT2A (1.00) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL6846377 0.83 KMT2A (0.73) MEN1KMT2AKDM4EMAPTLMNA
SCHEMBL5648499 0.83 KMT2A (0.68) MEN1KMT2AKDM4EMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230226074-A1 METHODS OF USE FOR PYRIMIDINES AS FERROPORTIN INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2023-07-20 US disclosed
US-20230183184-A1 3-(Carboxyethyl)-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives GRUENENTHAL GMBH (DE) 2023-06-15 US disclosed
US-20230183184-A1 3-(Carboxyethyl)-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives GRUENENTHAL GMBH (DE) 2023-06-15 US disclosed
EP-3652157-B1 1,3-DIAZA-SPIRO-[3.4]-OCTANE DERIVATIVES GRUENENTHAL GMBH (DE) 2021-05-05 EP disclosed
EP-3722283-A1 3-(CARBOXYETHYL)-8-AMINO-2-OXO-1,3-DIAZA-SPIRO-[4.5]-DECANE DERIVATIVES Grünenthal GmbH (DE) 2020-10-14 EP disclosed
EP-3402783-B1 3-(CARBOXYETHYL)-8-AMINO-2-OXO-1,3-DIAZA-SPIRO-[4.5]-DECANE DERIVATIVES GRUENENTHAL GMBH (DE) 2020-03-04 EP disclosed
WO-2019012037-A1 1,3-DIAZA-SPIRO-[3.4]-OCTANE DERIVATIVES Grünenthal GmbH (DE) 2019-01-17 WO disclosed
WO-2017121646-A1 3-(CARBOXYETHYL)-8-AMINO-2-OXO-1,3-DIAZA-SPIRO-[4.5]-DECANE DERIVATIVES Grünenthal GmbH (DE) 2017-07-20 WO disclosed
US-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE SHY Therapeutics LLC 2017-06-22 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 (3 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-20230226074-A1 METHODS OF USE FOR PYRIMIDINES AS FERROPORTIN INHIBITORS SLC40A1, HAMP, SLC19A1 MEN1 2863/4885KMT2A 4375/4885KDM4E 4699/4885
US-20230183184-A1 3-(Carboxyethyl)-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives OPRK1, OPRD1, PKD2 MEN1 2986/4885KMT2A 2284/4885KDM4E 1357/4885
US-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE MAPK6, MAP3K6, MAPK4 MEN1 4080/4885KMT2A 3544/4885KDM4E 3392/4885

“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.