SCHEMBL16319339

SCHEMBL16319339

CCOC(=O)CNc1cccc(OCc2ccccc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRK2 P25098 3/20 0.55
GRK3 P35626 3/20 0.55
GRK5 P34947 2/20 0.55
FFAR1 O14842 1/20 0.55
CTSV O60911 1/20 0.53
CTSL P07711 1/20 0.53
PDK1 Q15118 1/20 0.52
PDK2 Q15119 1/20 0.52
PDK3 Q15120 1/20 0.52
PDK4 Q16654 1/20 0.52
MAOB P27338 1/20 0.51
ALDH1A1 P00352 1/20 0.51
SIRT2 Q8IXJ6 1/20 0.51
LTA4H P09960 1/20 0.51
LMNA P02545 1/20 0.50
CYP2D6 P10635 1/20 0.50
NR4A2 P43354 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
NR1H4 Q96RI1 1/20 0.49

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
SCHEMBL10832939 0.91 FFAR1 (0.58) GRK2GRK3GRK5FFAR1CTSV
SCHEMBL8009616 0.88 FFAR1 (0.58) GRK2GRK3GRK5FFAR1CTSV
SCHEMBL23916262 0.87 HTT (0.52) GRK2ALDH1A1LMNAMEN1KMT2A
SCHEMBL5955117 0.86 ALDH1A1 (0.64) ALDH1A1LTA4HLMNAMEN1KMT2A
SCHEMBL5287947 0.84 FFAR1 (0.62) GRK2GRK3GRK5FFAR1CTSV
SCHEMBL28302706 0.84 PDK1 (0.57) GRK2GRK3GRK5FFAR1CTSV
SCHEMBL23283424 0.84 LTA4H (0.61) PDK1PDK2PDK3PDK4MAOB
SCHEMBL5229166 0.82 BCHE (0.62) FFAR1MAOBALDH1A1LTA4HCYP2D6
SCHEMBL9164404 0.82 PLA2G4B (0.49) FFAR1CYP2D6NR1H4SMPD1
SCHEMBL31748463 0.81 ALDH1A1 (0.47) CTSVCTSLALDH1A1LTA4HLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210353683-A1 ADDITIVE FOR MEDIUM FOR PROMOTING PRODUCTION OF PARACRINE FACTOR NISSAN CHEMICAL CORPORATION (JP) 2021-11-18 US disclosed
EP-3851519-A1 ADDITIVE FOR MEDIUM FOR PROMOTING PRODUCTION OF PARACRINE FACTOR Nissan Chemical Corporation (JP) 2021-07-21 EP disclosed
CN-112805268-A Medium supplement reagent for promoting production of paracrine factor 日产化学株式会社 2021-05-14 CN disclosed
US-20200165194-A1 ADDITIVE COMPOSITION FOR CULTURE MEDIUM, ADDITIVE COMPOUND FOR CULTURE MEDIUM, AND METHOD FOR CULTURE OF CELLS OR TISSUE USING SAME NISSAN CHEMICAL CORPORATION (JP) 2020-05-28 US disclosed
WO-2020067477-A1 ADDITIVE FOR MEDIUM FOR PROMOTING PRODUCTION OF PARACRINE FACTOR 日産化学株式会社 2020-04-02 WO disclosed
US-9181186-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-11-10 US disclosed
US-20150045378-A1 AROMATIC RING COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-02-12 US disclosed
EP-2816032-A1 AROMATIC RING COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-12-24 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 (3 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-20150045378-A1 AROMATIC RING COMPOUND GPR119, GPR27, GPR4 GRK2 153/4885GRK3 269/4885GRK5 120/4885
US-20210353683-A1 ADDITIVE FOR MEDIUM FOR PROMOTING PRODUCTION OF PARACRINE FACTOR HGF, HDGF, FGF2 GRK2 3303/4885GRK3 4193/4885GRK5 3279/4885
US-20200165194-A1 ADDITIVE COMPOSITION FOR CULTURE MEDIUM, ADDITIVE COMPOUND FOR CULTURE MEDIUM, AND METHOD FOR CULTURE OF CELLS OR TISSUE USING SAME NEFM, FGF2, FGF1 GRK2 2359/4885GRK3 3109/4885GRK5 1689/4885

“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.