SCHEMBL4848947

SCHEMBL4848947

COc1ccc(CC(C)(C)C(C)(C)C(=O)O)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.53
HIF1A Q16665 1/20 0.53
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
ATM Q13315 1/20 0.47
SLC2A1 P11166 2/20 0.45
HPGDS O60760 1/20 0.44
CDC25B P30305 2/20 0.43
PKM P14618 1/20 0.43
PLK1 P53350 1/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
STAT6 P42226 1/20 0.41
HSD17B10 Q99714 1/20 0.41
FABP4 P15090 3/20 0.41

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
SCHEMBL7280790 0.83 CYP2C9 (0.53) CYP2C9HIF1AKMT2AMEN1ATM
SCHEMBL7280783 0.83 CYP2C9 (0.53) CYP2C9HIF1AKMT2AMEN1ATM
SCHEMBL8851729 0.75 SLC2A1 (0.49) CYP2C9HIF1AKMT2AMEN1ATM
SCHEMBL4853510 0.74 CDC25B (0.56) CYP2C9HIF1AKMT2AHPGDSCDC25B
SCHEMBL1428333 0.73 CYP2C9 (0.58) CYP2C9HIF1AKMT2AMEN1ATM
SCHEMBL8429646 0.72 CYP2C9 (0.57) CYP2C9HIF1AKMT2AMEN1ATM
SCHEMBL2608801 0.72 CYP2C9 (0.57) CYP2C9HIF1AKMT2AMEN1ATM
SCHEMBL10871252 0.72 CYP2C9 (0.57) CYP2C9HIF1AKMT2AMEN1ATM
SCHEMBL15802462 0.72 SLC2A1 (0.58) CYP2C9HIF1AKMT2AMEN1ATM
SCHEMBL1599374 0.71 CYP2C9 (0.56) CYP2C9HIF1AKMT2AMEN1ATM

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-7459555-B2 Photochromic naphthopyrans RODENSTOCK GMBH (DE) 2008-12-02 US disclosed
US-20020052499-A1 Photochromic naphthopyrans OPTISCHE WERKE G. RODENSTOCK 2002-05-02 US disclosed
US-6342459-B1 PHOTOCHROMIC COMPOUNDS AND ARTICLES OF RESIN FOR OPTHTHALMIC LENSES OPTISCHE WERKE G. RODENSTOCK (DE) 2002-01-29 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-20020052499-A1 Photochromic naphthopyrans BPNT1, NR2E3, BRIX1 CYP2C9 1502/4885HIF1A 1807/4885KMT2A 3126/4885

“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.