SCHEMBL7108121

SCHEMBL7108121

Cc1cc([C@@H](C)C(=O)O)cc(C(C)(C)C)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
GLRA3 O75311 1/20 0.44
GLRB P48167 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.41
CA2 P00918 2/20 0.41
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
TYR P14679 1/20 0.41
AKR1C3 P42330 8/20 0.40
AKR1C2 P52895 8/20 0.40
CYP2D6 P10635 1/20 0.39
MEN1 O00255 1/20 0.39
GALR3 O60755 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CA1 P00915 1/20 0.38
GABRA1 P14867 1/20 0.38

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
SCHEMBL283603 1.00 CYP1A2 (0.50) CYP1A2CYP2C9CYP2C19GLRA3GLRB
SCHEMBL29408356 1.00 CYP1A2 (0.50) CYP1A2CYP2C9CYP2C19GLRA3GLRB
SCHEMBL38652043 0.98 CYP1A2 (0.49) CYP1A2CYP2C9CYP2C19GLRA3GLRB
SCHEMBL27505107 0.93 CYP1A2 (0.44) CYP1A2CYP2C9CYP2C19GLRA3GLRB
SCHEMBL11704980 0.90 CYP2C9 (0.50) CYP1A2CYP2C9CYP2C19GLRA3GLRB
SCHEMBL100584 0.90 GLRA3 (0.50) CYP1A2GLRA3GLRBSMN1; SMN2CA2
SCHEMBL6275312 0.90 GLRA3 (0.50) CYP1A2GLRA3GLRBSMN1; SMN2CA2
Methane SCHEMBL4556718 0.88 GLRA3 (0.48) CYP1A2GLRA3GLRBSMN1; SMN2CA2
Hydrochloric Acid SCHEMBL1874072 0.88 GLRA3 (0.48) CYP1A2GLRA3GLRBSMN1; SMN2CA2
SCHEMBL38652274 0.88 GLRA3 (0.48) CYP1A2GLRA3GLRBSMN1; SMN2CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030146412-A1 Phenyl ether-substituted hydroxyphenyl triazine ultraviolet light absorbers CYTEC TECHNOLOGY CORP. 2003-08-07 US claimed

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-20030146412-A1 Phenyl ether-substituted hydroxyphenyl triazine ultraviolet light absorbers CRYZ, AHR, ERCC4 CYP1A2 111/4885CYP2C9 1113/4885CYP2C19 1043/4885

“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.