SCHEMBL15280838

SCHEMBL15280838

CCCC(CP(=O)(O)COc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
FOLH1 Q04609 1/20 0.44
GRM3 Q14832 2/20 0.41
CHRM1 P11229 1/20 0.41
AKR1A1 P14550 1/20 0.41
CHRM3 P20309 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
ADRA1A P35348 1/20 0.41
HRH1 P35367 1/20 0.41
DRD3 P35462 1/20 0.41
SLC6A3 Q01959 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
TDP1 Q9NUW8 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
SCHEMBL2742765 0.86 GRM3 (0.59) CYP2C9CYP2C19FOLH1GRM3
SCHEMBL14927202 0.83 CYP2C9 (0.60) CYP2C9CYP2C19FOLH1GRM3
SCHEMBL5051270 0.78 MMP1 (0.59) FOLH1
SCHEMBL7051219 0.75 FOLH1 (0.41) FOLH1GRM3CHRM1AKR1A1CHRM3
SCHEMBL5515375 0.75 TDP1 (0.59) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL2742758 0.73 CHRM1 (0.58) FOLH1GRM3CHRM1AKR1A1CHRM3
SCHEMBL7051220 0.72 PPARG (0.45) CYP2C9CYP2C19
SCHEMBL15965757 0.72 GCLC (0.57) FOLH1GRM3CHRM1AKR1A1CHRM3
SCHEMBL5057818 0.71 MMP1 (0.52) FOLH1
SCHEMBL9056789 0.71 CYP2C9 (0.64) CYP2C9CYP2C19CHRM1CHRM3HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180125854-A1 THERAPEUTIC NANOPARTICLES COMPRISING A THERAPEUTIC AGENT AND METHODS OF MAKING AND USING THE SAME PFIZER INC. (US) 2018-05-10 US disclosed
US-9895378-B2 Therapeutic nanoparticles comprising a therapeutic agent and methods of making and using the same PFIZER INC. (US) 2018-02-20 US disclosed
US-20170151181-A1 METHODS OF TREATING CANCERS WITH THERAPEUTIC NANOPARTICLES PFIZER INC. (US) 2017-06-01 US disclosed
US-20170119672-A1 Therapeutic Nanoparticles Comprising A Therapeutic Agent And Methods Of Making And Using Same PFIZER INC. (US) 2017-05-04 US disclosed
US-20170049709-A1 THERAPEUTIC NANOPARTICLES COMPRISING A THERAPEUTIC AGENT AND METHODS OF MAKING AND USING SAME PFIZER INC. 2017-02-23 US disclosed
US-20170042828-A1 THERAPEUTIC NANOPARTICLES COMPRISING A THERAPEUTIC AGENT AND METHODS OF MAKING AND USING SAME PFIZER INC. 2017-02-16 US disclosed
US-20170042855-A1 NANOPARTICLES COMPRISING DOCETAXEL FOR TREATING CANCERS HAVING A K-RAS MUTATION BIND THERAPEUTICS, INC. 2017-02-16 US disclosed
US-20160338959-A1 DRUG LOADED POLYMERIC NANOPARTICLES AND METHODS OF MAKING AND USING SAME PFIZER INC. 2016-11-24 US disclosed
US-20150258102-A1 THERAPEUTIC NANOPARTICLES COMPRISING A THERAPEUTIC AGENT AND METHODS OF MAKING AND USING SAME PFIZER INC. 2015-09-17 US disclosed
US-20140249158-A1 Therapeutic Nanoparticles Comprising a Therapeutic Agent and Methods of Making and Using Same BIND THERAPEUTICS, INC. (US) 2014-09-04 US disclosed
US-20140248358-A1 Therapeutic Nanoparticles Comprising a Therapeutic Agent and Methods of Making and Using Same BIND THERAPEUTICS, INC. (US) 2014-09-04 US disclosed
US-20140178475-A1 Therapeutic Nanoparticles Comprising a Therapeutic Agent and Methods of Making and Using Same BIND THERAPEUTICS, INC. (US) 2014-06-26 US disclosed
US-20130251816-A1 CANCER CELL TARGETING USING NANOPARTICLES BIND THERAPEUTICS, INC. (US) 2013-09-26 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 (12 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-20140248358-A1 Therapeutic Nanoparticles Comprising a Therapeutic Agent and Methods of Making and Using Same CD44, NCL, TP53 CYP2C9 4841/4885CYP2C19 4836/4885FOLH1 40/4885
US-20130251816-A1 CANCER CELL TARGETING USING NANOPARTICLES CD47, EPCAM, CD44 CYP2C9 4468/4885CYP2C19 4474/4885FOLH1 279/4885
US-20150258102-A1 THERAPEUTIC NANOPARTICLES COMPRISING A THERAPEUTIC AGENT AND METHODS OF MAKING AND USING SAME TP53, VHL, MTDH CYP2C9 4813/4885CYP2C19 4740/4885FOLH1 292/4885
US-20140178475-A1 Therapeutic Nanoparticles Comprising a Therapeutic Agent and Methods of Making and Using Same CD44, NCL, TP53 CYP2C9 4841/4885CYP2C19 4836/4885FOLH1 40/4885
US-20160338959-A1 DRUG LOADED POLYMERIC NANOPARTICLES AND METHODS OF MAKING AND USING SAME LDHA, LDHB, LPXN CYP2C9 2956/4885CYP2C19 3149/4885FOLH1 177/4885
US-20170119672-A1 Therapeutic Nanoparticles Comprising A Therapeutic Agent And Methods Of Making And Using Same CD44, NCL, TP53 CYP2C9 4841/4885CYP2C19 4836/4885FOLH1 40/4885
US-20140249158-A1 Therapeutic Nanoparticles Comprising a Therapeutic Agent and Methods of Making and Using Same CD44, NCL, TP53 CYP2C9 4841/4885CYP2C19 4836/4885FOLH1 40/4885
US-20180125854-A1 THERAPEUTIC NANOPARTICLES COMPRISING A THERAPEUTIC AGENT AND METHODS OF MAKING AND USING THE SAME TP53, HNRNPH3, VHL CYP2C9 4856/4885CYP2C19 4837/4885FOLH1 336/4885
US-20170042828-A1 THERAPEUTIC NANOPARTICLES COMPRISING A THERAPEUTIC AGENT AND METHODS OF MAKING AND USING SAME CD44, NCL, TP53 CYP2C9 4841/4885CYP2C19 4836/4885FOLH1 40/4885
US-20170151181-A1 METHODS OF TREATING CANCERS WITH THERAPEUTIC NANOPARTICLES KRAS, TP53, NRAS CYP2C9 4745/4885CYP2C19 4798/4885FOLH1 336/4885
US-20170042855-A1 NANOPARTICLES COMPRISING DOCETAXEL FOR TREATING CANCERS HAVING A K-RAS MUTATION KRAS, NRAS, HRAS CYP2C9 4284/4885CYP2C19 4441/4885FOLH1 1995/4885
US-20170049709-A1 THERAPEUTIC NANOPARTICLES COMPRISING A THERAPEUTIC AGENT AND METHODS OF MAKING AND USING SAME CTSA, GAA, EEA1 CYP2C9 4878/4885CYP2C19 4872/4885FOLH1 135/4885

“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.