SCHEMBL9934162

SCHEMBL9934162

COC(=O)c1cc(OC(C)=O)c2cc(-c3ccccc3)ccc2c1-c1cccc(OC)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.46
MAPT P10636 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
JAK2 O60674 2/20 0.42
PLA2G2A P14555 1/20 0.42
TRPV1 Q8NER1 1/20 0.41
HSD17B1 P14061 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
FPR1 P21462 1/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
HDAC2 Q92769 1/20 0.40
FFAR1 O14842 1/20 0.40
GPR35 Q9HC97 1/20 0.40
PLAU P00749 1/20 0.40

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
SCHEMBL9899016 0.90 NR4A2 (0.50) NR4A2MAPTTDP1MEN1KMT2A
SCHEMBL1010947 0.88 DHODH (0.48) NR4A2KMT2A
SCHEMBL8510685 0.88 PLA2G2A (0.51) NR4A2MAPTPLA2G2A
SCHEMBL9899615 0.86 PLA2G2A (0.49) NR4A2MAPTTDP1PLA2G2A
SCHEMBL6383895 0.83 BACE1 (0.51) NR4A2MAPTTDP1PLA2G2AFPR1
SCHEMBL9899201 0.83 NR4A2 (0.46) NR4A2MAPTTDP1MEN1KMT2A
SCHEMBL1011786 0.82 DHODH (0.45) NR4A2MAPTPOLBKMT2A
SCHEMBL1009498 0.80 TSHR (0.48) NR4A2MAPTTDP1MEN1KMT2A
SCHEMBL1332988 0.79 KDM4E (0.46) MAPTPOLBKMT2A
SCHEMBL31435276 0.79 KDM4E (0.46) MAPTPOLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651914-B1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL INC (US) 2015-05-13 EP disclosed
US-8920928-B2 Photochromic compounds and compositions TRANSITIONS OPTICAL, INC. (US) 2014-12-30 US disclosed
EP-2651914-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS Transitions Optical, Inc. (US) 2013-10-23 EP disclosed
US-20120156508-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 US disclosed
WO-2012082999-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 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-20120156508-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS CRY2, CRY1, IPO4 NR4A2 337/4885MAPT 562/4885TDP1 892/4885

“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.