SCHEMBL15401797

SCHEMBL15401797

Cc1cc(C)c(NC(=O)c2ccccc2)c(C)c1N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
CYP1A2 P05177 2/20 0.54
CYP2C19 P33261 2/20 0.54
CYP2C9 P11712 1/20 0.54
SMN1; SMN2 Q16637 4/20 0.51
TP53 P04637 2/20 0.51
NFKB1 P19838 2/20 0.51
NFKB2 Q00653 2/20 0.51
RELA Q04206 2/20 0.51
GAA P10253 1/20 0.51
ALOX15 P16050 1/20 0.51
HSD17B10 Q99714 1/20 0.51
HTT P42858 1/20 0.51
KMT2A Q03164 3/20 0.50
POLB P06746 1/20 0.50
HPGD P15428 1/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
CCNA2 P20248 1/20 0.47

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
SCHEMBL27645790 0.78 LCK (0.66) MAPTSMN1; SMN2TP53NFKB1NFKB2
SCHEMBL7341189 0.77 PTGER4 (0.58) MAPTCYP1A2CYP2C19CYP2C9SMN1; SMN2
SCHEMBL1445721 0.76 ALDH1A1 (0.47) CYP1A2CYP2C19GAAHSD17B10POLB
SCHEMBL12284720 0.76 HTT (0.55) MAPTCYP1A2CYP2C19CYP2C9SMN1; SMN2
SCHEMBL13091251 0.75 ALDH1A1 (0.54) MAPTCYP1A2CYP2C19CYP2C9SMN1; SMN2
SCHEMBL532849 0.75 SMN1; SMN2 (0.49) MAPTSMN1; SMN2TP53NFKB1NFKB2
SCHEMBL4201818 0.75 NPC1 (0.57) MAPTCYP1A2CYP2C19CYP2C9SMN1; SMN2
SCHEMBL4138460 0.74 POLB (0.67) MAPTSMN1; SMN2KMT2APOLBHPGD
SCHEMBL15014133 0.74 HTT (0.54) MAPTCYP1A2CYP2C19CYP2C9SMN1; SMN2
SCHEMBL8616512 0.74 ALDH1A1 (0.67) MAPTCYP1A2CYP2C19CYP2C9SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140004458-A1 MAGENTA TONER CANON KABUSHIKI KAISHA (JP) 2014-01-02 US disclosed
US-20140005417-A1 WATER-INSOLUBLE COLORING COMPOUND, INK, RESIST COMPOSITION FOR COLOR FILTER, AND THERMAL TRANSFER RECORDING SHEET CANON KABUSHIKI KAISHA (JP) 2014-01-02 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 (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-20140005417-A1 WATER-INSOLUBLE COLORING COMPOUND, INK, RESIST COMPOSITION FOR COLOR FILTER, AND THERMAL TRANSFER RECORDING SHEET SMARCA2, SMARCD2, SMARCA1 MAPT 59/4885CYP1A2 1614/4885CYP2C19 1376/4885

“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.