SCHEMBL4064336

SCHEMBL4064336

CC(C)(C)OC(=O)Oc1ccc(C#Cc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.58
FFAR1 O14842 7/20 0.50
KDM1A O60341 1/20 0.44
ACACB O00763 3/20 0.43
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HAO1 Q9UJM8 1/20 0.40
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
NLRP3 Q96P20 1/20 0.39

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
SCHEMBL11771781 0.84 ELANE (0.67) ELANEKDM1AMAPTTDP1L3MBTL1
SCHEMBL82142 0.84 ELANE (0.67) ELANEKDM1AMAPTTDP1L3MBTL1
SCHEMBL4061370 0.82 ELANE (0.81) ELANEKDM1AMAPTTDP1L3MBTL1
SCHEMBL4064862 0.82 ACACB (0.60) ELANEACACBL3MBTL1
SCHEMBL26667035 0.81 FFAR1 (0.54) FFAR1ACACBPPARGPPARAL3MBTL1
SCHEMBL4060624 0.81 ELANE (0.64) ELANEKDM1AMAPTTDP1L3MBTL1
SCHEMBL4065386 0.81 ELANE (0.51) ELANEACACBKMT2A
SCHEMBL29084159 0.80 ELANE (0.63) ELANEFFAR1PPARGPPARA
SCHEMBL12604846 0.79 ELANE (0.60) ELANEKDM1AMAPTTDP1L3MBTL1
SCHEMBL4062398 0.78 MAOB (0.56) ELANEFFAR1PPARGMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7534547-B2 Optically active compound and photosensitive resin composition OSAKA GAS COMPANY LIMITED (JP) 2009-05-19 US disclosed
US-7534547-B2 Optically active compound and photosensitive resin composition OSAKA GAS COMPANY LIMITED (JP) 2009-05-19 US disclosed
EP-1375463-A1 OPTICALLY ACTIVE COMPOUND AND PHOTOSENSITIVE RESIN COMPOSITION Kansai Research Institute, Inc. (JP) 2004-01-02 EP disclosed
US-20030211421-A1 Optically active compound and photosensitive resin composition KRI, INC. (JP) 2003-11-13 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-20030211421-A1 Optically active compound and photosensitive resin composition ARCN1, RAD51, PAM ELANE 422/4885FFAR1 1120/4885KDM1A 113/4885

“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.