SCHEMBL4728857

SCHEMBL4728857

Cc1ccc2c(c1)OC(C)(C)CC2=O

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.69
ALDH1A1 P00352 3/20 0.69
MAOB P27338 11/20 0.63
MAPT P10636 2/20 0.55
HTR2C P28335 1/20 0.53
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
PDE4B Q07343 1/20 0.48
ATM Q13315 2/20 0.48
HTT P42858 1/20 0.48
MAPK1 P28482 1/20 0.46
RAD52 P43351 1/20 0.46

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
SCHEMBL68892 0.86 MAPT (0.69) KDM4EALDH1A1MAOBMAPTNPC1
SCHEMBL6385719 0.83 ALDH1A1 (0.69) KDM4EALDH1A1MAOBMAPTNPC1
SCHEMBL29640611 0.81 ALDH1A1 (0.67) KDM4EALDH1A1MAOBMAPTHTR2C
SCHEMBL1569957 0.81 ALDH1A1 (0.67) KDM4EALDH1A1MAOBMAPTNPC1
SCHEMBL29922134 0.81 ALDH1A1 (0.67) KDM4EALDH1A1MAOBMAPTNPC1
SCHEMBL6552997 0.81 ALDH1A1 (0.67) KDM4EALDH1A1MAOBMAPTHTR2C
SCHEMBL4727223 0.81 ALDH1A1 (0.67) KDM4EALDH1A1MAOBMAPTNPC1
SCHEMBL2319848 0.81 ALDH1A1 (0.67) KDM4EALDH1A1MAOBMAPTNPC1
SCHEMBL1983108 0.81 ALDH1A1 (1.00) KDM4EALDH1A1MAOBMAPTHTR2C
SCHEMBL30132496 0.81 ALDH1A1 (1.00) KDM4EALDH1A1MAOBMAPTHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250042911-A1 NOVEL BENZOPYRAN DERIVATIVE AND USE THEREOF SPARK BIOPHARMA, INC. (KR) 2025-02-06 US disclosed
EP-4365175-A1 NOVEL BENZOPYRAN DERIVATIVE AND USE THEREOF Spark Biopharma, Inc. (KR) 2024-05-08 EP disclosed
WO-2023277656-A1 NOVEL BENZOPYRAN DERIVATIVE AND USE THEREOF (주)스파크바이오파마 2023-01-05 WO disclosed
US-20170066717-A1 NEW PHENYLAZETIDINECARBOXYLATE OR -CARBOXAMIDE COMPOUNDS INVENTIVA (FR) 2017-03-09 US disclosed
EP-3107910-A1 NEW PHENYLAZETIDINE, CARBOXYLATE OR CARBOXAMIDE COMPOUNDS INVENTIVA (FR) 2016-12-28 EP disclosed
WO-2015124868-A1 NEW PHENYLAZETIDINE, CARBOXYLATE OR CARBOXAMIDE COMPOUNDS INVENTIVA (FR) 2015-08-27 WO disclosed
EP-2154213-A1 Ink-jet ink composition, and ink-jet recording method Fujifilm Corporation (JP) 2010-02-17 EP disclosed
WO-2008035356-A2 NOVEL CANNABINOID RECEPTOR LIGANDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESS FOR THEIR PREPARATION GLENMARK PHARMACEUTICALS LIMITED (IN) 2008-03-27 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 (2 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-20250042911-A1 NOVEL BENZOPYRAN DERIVATIVE AND USE THEREOF MYD88, MYADM, CD14 KDM4E 588/4885ALDH1A1 2146/4885MAOB 3668/4885
US-20170066717-A1 NEW PHENYLAZETIDINECARBOXYLATE OR -CARBOXAMIDE COMPOUNDS NCOR1, NCOR2, NCOA1 KDM4E 517/4885ALDH1A1 600/4885MAOB 567/4885

“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.