SCHEMBL3341018

SCHEMBL3341018

C=CCOP(=O)(OCC=C)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
ALOX15 P16050 1/20 0.45
ELANE P08246 1/20 0.43
SRC P12931 1/20 0.41
CETP P11597 3/20 0.41
PKM P14618 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP3A4 P08684 1/20 0.37
PDPK1 O15530 1/20 0.37
MTOR P42345 1/20 0.37
ALPG P10696 1/20 0.37
PTK2B Q14289 1/20 0.37
BCHE P06276 1/20 0.36
IDO1 P14902 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
SCHEMBL11276825 1.00 TSHR (0.52) TSHRALOX15ELANESRCCETP
SCHEMBL14556164 0.85 TSHR (0.55) TSHRELANESRCCETPPDPK1
SCHEMBL206609 0.84 TSHR (0.68) TSHRELANESRCCETPPDPK1
SCHEMBL19949766 0.83 IDO1 (0.40) SMN1; SMN2IDO1
SCHEMBL731609 0.83 TSHR (0.73) TSHRALOX15SRCCETPPKM
Benzene SCHEMBL28276614 0.82 PKM (0.37) TSHRALOX15PKMSMN1; SMN2CYP3A4
SCHEMBL3345886 0.82 TSHR (0.52) TSHRELANESRCCETPPDPK1
SCHEMBL16394946 0.80 L3MBTL1 (0.46) TSHRPKMSMN1; SMN2IDO1
SCHEMBL2301938 0.79 TSHR (0.57) TSHRELANESRCCETPPDPK1
SCHEMBL5379773 0.79 TSHR (0.61) TSHRELANESRCCETPPDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3510035-B1 DUAL PROTECTED PRO-COELENTERAZINE SUBSTRATES PROMEGA CORP (US) 2021-04-07 EP disclosed
EP-3510035-A1 DUAL PROTECTED PRO-COELENTERAZINE SUBSTRATES Promega Corporation (US) 2019-07-17 EP disclosed
US-10316070-B2 Dual protected pro-coelenterazine substrates PROMEGA CORPORATION (US) 2019-06-11 US disclosed
US-20180072781-A1 DUAL PROTECTED PRO-COELENTERAZINE SUBSTRATES JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2018-03-15 US disclosed
WO-2018049241-A1 DUAL PROTECTED PRO-COELENTERAZINE SUBSTRATES PROMEGA CORPORATION (US) 2018-03-15 WO disclosed
US-8772327-B2 Phenylpropionic acid derivative and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2014-07-08 US disclosed
US-20130131134-A1 PHENYLPROPIONIC ACID DERIVATIVE AND USE THEREOF MORITA KOHEI (JP) 2013-05-23 US disclosed
US-8334314-B2 Phenylpropionic acid derivative and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2012-12-18 US disclosed
US-20100093819-A1 PHENYLPROPIONIC ACID DERIVATIVE AND USE THEREOF ASAHI KASEI PHARMA CORPORATION (JP) 2010-04-15 US disclosed
EP-0432688-B1 Magnetic carrier for use in electrophotographic development TDK CORP (JP) 1997-03-12 EP disclosed
US-5354638-A Magnetic carrier for use in electrophotographic development TDK CORPORATION (JP) 1994-10-11 US disclosed
EP-0432688-A1 Magnetic carrier for use in electrophotographic development TDK Corporation (JP) 1991-06-19 EP 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 (4 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-10316070-B2 Dual protected pro-coelenterazine substrates SI, GLB1, CTRL TSHR 3314/4885ALOX15 2353/4885ELANE 1099/4885
US-20130131134-A1 PHENYLPROPIONIC ACID DERIVATIVE AND USE THEREOF PLA2G12A, PLA2G4A, PLA2G4B TSHR 4126/4885ALOX15 25/4885ELANE 116/4885
US-20100093819-A1 PHENYLPROPIONIC ACID DERIVATIVE AND USE THEREOF PLA2G12A, PLA2G4A, PLA2G4B TSHR 4126/4885ALOX15 25/4885ELANE 116/4885
US-20180072781-A1 DUAL PROTECTED PRO-COELENTERAZINE SUBSTRATES SI, GLB1, PREP TSHR 3501/4885ALOX15 3790/4885ELANE 1066/4885

“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.