SCHEMBL4065877

SCHEMBL4065877

COc1cc(C)c2c(c1)C(=O)CC2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
KDM4E B2RXH2 5/20 0.43
HPGD P15428 4/20 0.43
HTT P42858 2/20 0.40
GLA P06280 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP1A2 P05177 1/20 0.39
GAA P10253 1/20 0.39
EGFR P00533 1/20 0.38
ELANE P08246 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAP2K3 P46734 1/20 0.36

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
SCHEMBL3647831 0.91 EGFR (0.44) ALDH1A1KDM4EHPGDHTTCYP3A4
SCHEMBL25196987 0.81 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDHTTGLA
SCHEMBL30047417 0.81 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDHTTGLA
SCHEMBL7184636 0.79 SMN1; SMN2 (0.45) ALDH1A1KDM4EHPGDHTTGAA
SCHEMBL1508681 0.78 TYMS (0.46) ALDH1A1KDM4EHPGDMEN1LMNA
SCHEMBL30832653 0.78 TYMS (0.46) ALDH1A1KDM4EHPGDMEN1LMNA
SCHEMBL6881483 0.78 KDM4E (0.46) ALDH1A1KDM4EHPGDHTTGLA
SCHEMBL22477045 0.77 EGFR (0.41) ALDH1A1KDM4EHPGDHTTCYP3A4
SCHEMBL3629797 0.76 KDM4E (0.44) ALDH1A1KDM4EHPGDHTTGLA
SCHEMBL11765642 0.76 PIK3CD (0.34) ALDH1A1KDM4EHPGDCYP3A4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230331710-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD AND USE THEREOF SHANGHAI MEIYUE BIOTECH DEVELOPMENT CO. LTD (CN) 2023-10-19 US disclosed
US-20230331710-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD AND USE THEREOF SHANGHAI MEIYUE BIOTECH DEVELOPMENT CO. LTD (CN) 2023-10-19 US disclosed
EP-4194449-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Meiyue Biotech Development Co., Ltd. (CN) 2023-06-14 EP disclosed
US-20090326018-A1 2-Phenyl indene derivatives useful as estrogen receptor ligands KARO BIO AB (SE) 2009-12-31 US disclosed
US-20090326018-A1 2-Phenyl indene derivatives useful as estrogen receptor ligands KARO BIO AB (SE) 2009-12-31 US disclosed
US-20090326018-A1 2-Phenyl indene derivatives useful as estrogen receptor ligands KARO BIO AB (SE) 2009-12-31 US disclosed
WO-2009121910-A1 INDENE DERIVATIVES AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2009-10-08 WO disclosed
WO-2009121910-A1 INDENE DERIVATIVES AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2009-10-08 WO disclosed
EP-2074102-A1 2-PHENYL INDENE DERIVATIVES USEFUL AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2009-07-01 EP disclosed
WO-2008043567-A1 2-PHENYL INDENE DERIVATIVES USEFUL AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2008-04-17 WO disclosed
WO-2008043567-A1 2-PHENYL INDENE DERIVATIVES USEFUL AS ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2008-04-17 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-20230331710-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD AND USE THEREOF C9, CFB, C5 ALDH1A1 3003/4885KDM4E 3798/4885HPGD 153/4885
US-20090326018-A1 2-Phenyl indene derivatives useful as estrogen receptor ligands ESR1, GPER1, ESR2 ALDH1A1 1020/4885KDM4E 1602/4885HPGD 1308/4885

“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.