SCHEMBL4279588

SCHEMBL4279588

CC(C)COc1ccc(C(=O)O)c(F)c1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.50
RARA P10276 1/20 0.48
RARB P10826 1/20 0.48
MAOA P21397 1/20 0.48
NR1H4 Q96RI1 3/20 0.47
ALDH1A1 P00352 1/20 0.46
FFAR1 O14842 1/20 0.46
PPARD Q03181 1/20 0.46
TARBP2 Q15633 1/20 0.45

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
SCHEMBL4277702 0.85 ALDH1A1 (0.53) MAOBMAOAALDH1A1
SCHEMBL5648170 0.85 MAPK1 (0.59) MAOBRARARARBMAOANR1H4
SCHEMBL2958827 0.83 NR1H4 (0.51) NR1H4ALDH1A1TARBP2
SCHEMBL13366264 0.82 RARA (0.55) MAOBRARARARBMAOAALDH1A1
SCHEMBL18648451 0.82 NR1H4 (0.45) NR1H4ALDH1A1
SCHEMBL21327850 0.81 NR1H4 (0.47) NR1H4ALDH1A1TARBP2
SCHEMBL9197144 0.81 TSHR (0.47) NR1H4ALDH1A1
SCHEMBL2590126 0.80 ALDH1A1 (0.71) MAOBRARARARBMAOAALDH1A1
SCHEMBL18793210 0.80 MAOB (0.51) MAOBRARARARBMAOA
SCHEMBL8493184 0.79 NR1H4 (0.48) NR1H4ALDH1A1TARBP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090118169-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL USE THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2009-05-07 US disclosed
CN-101284865-A Novel compound and medical use thereof TOYAMA CHEMICAL CO LTD (JP) 2008-10-15 CN disclosed
CN-100378063-C Novel compound and medical use thereof TOYAMA CHEMICAL CO LTD (JP) 2008-04-02 CN disclosed
US-7314888-B1 Compounds and medicinal use thereof TOYAMA CHEMICAL CO., LTD. (JP) 2008-01-01 US disclosed
EP-1127869-A1 NOVEL COMPOUNDS AND MEDICINAL USE THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2001-08-29 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 (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-20090118169-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL USE THEREOF SP1, AP1G1, AP1M1 MAOB 4012/4885RARA 2931/4885RARB 2407/4885

“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.