SCHEMBL30130002

SCHEMBL30130002

CC(C)(C)OC(=O)NCc1cc2cc(OCc3ccccc3)ccc2[nH]1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.60
▸ MAOB P27338 1/20 0.60
▸ KDM4E B2RXH2 3/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ HPGD P15428 1/20 0.56
▸ SRD5A2 P31213 1/20 0.56
▸ HSD17B10 Q99714 1/20 0.56
▸ PDGFRB P09619 1/20 0.53
▸ PDGFRA P16234 1/20 0.53
▸ FLT3 P36888 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ HDAC1 Q13547 2/20 0.47
▸ HDAC2 Q92769 1/20 0.47
▸ PRMT5 O14744 1/20 0.44
▸ CFD P00746 1/20 0.44
▸ PTPN1 P18031 2/20 0.44
▸ NPC1 O15118 1/20 0.42
▸ MAPT P10636 1/20 0.42

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
SCHEMBL30130048 0.81 SMN1; SMN2 (0.56) PDGFRBFLT3SMN1; SMN2NPC1RAB9A
SCHEMBL25677972 0.81 KDM4A (0.54) ALDH1A1CYP1A2SMN1; SMN2HDAC1HDAC2
SCHEMBL30469092 0.81 KDM4A (0.54) ALDH1A1CYP1A2SMN1; SMN2HDAC1HDAC2
SCHEMBL24510730 0.80 PTPN1 (0.53) MAOAMAOBSMN1; SMN2HDAC1PTPN1
SCHEMBL596575 0.78 HDAC1 (0.67) MAOBSMN1; SMN2HDAC1NPC1RAB9A
SCHEMBL22111129 0.78 PDGFRB (0.66) KDM4EALDH1A1CYP1A2CYP2C9HPGD
SCHEMBL29783684 0.78 PDGFRB (0.66) KDM4EALDH1A1CYP1A2CYP2C9HPGD
SCHEMBL853596 0.78 KDM4E (0.62) MAOAMAOBKDM4EALDH1A1CYP1A2
SCHEMBL30130020 0.78 SMN1; SMN2 (0.48) KDM4EALDH1A1HPGDPDGFRBPDGFRA
SCHEMBL19964551 0.78 SMN1; SMN2 (0.55) FLT3SMN1; SMN2HDAC1HDAC2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240124399-A1 NOVEL INDOLE DERIVATIVE, AND USE THEREOF FOR TREATING DISEASES RELATED TO ADVANCED GLYCATION END PRODUCTS METACEN THERAPEUTICS (KR) 2024-04-18 — — US disclosed
EP-4353710-A1 NOVEL INDOLE DERIVATIVE, AND USE THEREOF FOR TREATING DISEASES RELATED TO ADVANCED GLYCATION END PRODUCTS Metacen Therapeutics (KR) 2024-04-17 — — EP disclosed
WO-2022260491-A1 NOVEL INDOLE DERIVATIVE, AND USE THEREOF FOR TREATING DISEASES RELATED TO ADVANCED GLYCATION END PRODUCTS 주식회사 메타센테라퓨틱스 2022-12-15 — — 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-20240124399-A1 NOVEL INDOLE DERIVATIVE, AND USE THEREOF FOR TREATING DISEASES RELATED TO ADVANCED GLYCATION END PRODUCTS AGER, IDO1, IDO2 MAOA 54/4885MAOB 124/4885KDM4E 586/4885

“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.

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