SCHEMBL9899201

SCHEMBL9899201

COC(=O)c1cc(OC(C)=O)c2ccccc2c1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.46
TSHR P16473 2/20 0.46
HTT P42858 1/20 0.46
KDM4E B2RXH2 5/20 0.45
CFD P00746 1/20 0.42
DHODH Q02127 1/20 0.42
AXL P30530 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
BACE1 P56817 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
ESR1 P03372 1/20 0.41
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
HMGB1 P09429 1/20 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
SCHEMBL1009498 0.97 TSHR (0.48) NR4A2TSHRHTTKDM4ECFD
SCHEMBL9899016 0.92 NR4A2 (0.50) NR4A2TSHRKDM4ECFDAXL
SCHEMBL3137352 0.90 SLC6A3 (0.49) NR4A2TSHRHTTKDM4ECFD
SCHEMBL1011786 0.89 DHODH (0.45) NR4A2TSHRHTTKDM4EDHODH
SCHEMBL9899615 0.88 PLA2G2A (0.49) NR4A2HTTKDM4ETDP1BACE1
SCHEMBL1334088 0.86 DHODH (0.53) TSHRHTTKDM4EDHODHMAPT
SCHEMBL1332988 0.86 KDM4E (0.46) TSHRHTTKDM4EDHODHMAPT
SCHEMBL31435276 0.86 KDM4E (0.46) TSHRHTTKDM4EDHODHMAPT
SCHEMBL9933401 0.86 DHODH (0.42) NR4A2TSHRKDM4EDHODHTDP1
SCHEMBL8510685 0.85 PLA2G2A (0.51) NR4A2HTTKDM4EBACE1MAPT

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-9028728-B2 Photochromic materials that include indeno-fused naphthopyrans TRANSITIONS OPTICAL, INC. (US) 2015-05-12 US disclosed
WO-2013086248-A1 PHOTOCHROMIC MATERIALS THAT INCLUDE INDENO-FUSED NAPHTHOPYRANS PPG INDUSTRIES, INC. (US) 2013-06-13 WO disclosed
US-20120145973-A1 Photochromic Materials That Include Indeno-Fused Naphthopyrans TRANSITIONS OPTICAL INC. (US) 2012-06-14 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-20120145973-A1 Photochromic Materials That Include Indeno-Fused Naphthopyrans NQO1, INTS6, IPO4 NR4A2 1023/4885TSHR 4755/4885HTT 1417/4885

“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.