SCHEMBL4262893

SCHEMBL4262893

C=Cc1cc(CCC(=O)O)ccc1OC(C)C

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 6/20 0.53
FFAR1 O14842 2/20 0.53
P2RX3 P56373 1/20 0.47
S1PR5 Q9H228 10/20 0.46
S1PR1 P21453 10/20 0.46
S1PR3 Q99500 5/20 0.46
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL10316590 0.84 P2RX3 (0.40) FFAR4FFAR1P2RX3S1PR1KDM4E
SCHEMBL925619 0.82 AKR1C3 (0.42) FFAR4FFAR1P2RX3
SCHEMBL5133238 0.82 AKR1C3 (0.42) FFAR4FFAR1P2RX3
SCHEMBL927054 0.80 CSNK2A1 (0.41) P2RX3KDM4E
SCHEMBL3827746 0.80 P2RX3 (0.41) P2RX3KDM4E
SCHEMBL13346971 0.79 AKR1C3 (0.38) FFAR4FFAR1P2RX3S1PR5S1PR1
SCHEMBL13038559 0.79 AKR1C3 (0.38) FFAR4FFAR1P2RX3S1PR5S1PR1
SCHEMBL3688727 0.79 S1PR1 (0.59) FFAR4FFAR1S1PR5S1PR1S1PR3
SCHEMBL1272507 0.77 CSNK2A1 (0.59) P2RX3KDM4E
SCHEMBL18360184 0.76 KMT2A (0.49) KDM4E

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
US-20190309001-A1 RECYCLABLE METATHESIS CATALYSTS THE TRUSTEES OF BOSTON COLLEGE 2019-10-10 US disclosed
US-10336781-B2 Recyclable metathesis catalysts THE TRUSTEES OF BOSTON COLLEGE (US) 2019-07-02 US disclosed
US-20160168181-A1 RECYCLABLE METATHESIS CATALYSTS THE TRUSTEES OF BOSTON COLLEGE 2016-06-16 US disclosed
US-20160168181-A1 RECYCLABLE METATHESIS CATALYSTS THE TRUSTEES OF BOSTON COLLEGE 2016-06-16 US disclosed
CN-102145304-B Preparation of loaded Grubbs catalyst and application of loaded Grubbs catalyst UNIV EAST CHINA NORMAL 2012-08-08 CN disclosed
CN-102145304-A Preparation of loaded Grubbs catalyst and application of loaded Grubbs catalyst UNIV EAST CHINA NORMAL 2011-08-10 CN disclosed
US-20100292486-A1 RECYCLABLE METATHESIS CATALYSTS HOVEYDA AMIR H 2010-11-18 US disclosed
US-20100292486-A1 RECYCLABLE METATHESIS CATALYSTS HOVEYDA AMIR H 2010-11-18 US disclosed
US-7723255-B2 Recyclable metathesis catalysts THE TRUSTEES OF BOSTON COLLEGE (US) 2010-05-25 US disclosed
US-7723255-B2 Recyclable metathesis catalysts THE TRUSTEES OF BOSTON COLLEGE (US) 2010-05-25 US disclosed
WO-2009009597-A1 WATER SOLUBLE OLEFIN METATHESIS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-01-15 WO disclosed
WO-2009009597-A1 WATER SOLUBLE OLEFIN METATHESIS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-01-15 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 (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-20190309001-A1 RECYCLABLE METATHESIS CATALYSTS DNMT1, CARM1, ZMYND8 FFAR4 2332/4885FFAR1 2576/4885P2RX3 3801/4885
US-20100292486-A1 RECYCLABLE METATHESIS CATALYSTS DNMT1, CARM1, ZMYND8 FFAR4 2332/4885FFAR1 2576/4885P2RX3 3801/4885
US-10336781-B2 Recyclable metathesis catalysts DNMT1, CARM1, ZMYND8 FFAR4 2332/4885FFAR1 2576/4885P2RX3 3801/4885
US-20160168181-A1 RECYCLABLE METATHESIS CATALYSTS DNMT1, CARM1, ZMYND8 FFAR4 2332/4885FFAR1 2576/4885P2RX3 3801/4885

“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.