SCHEMBL14877337

SCHEMBL14877337

Cc1cc(N)cc(C=O)c1-c1c(C)cc(N)cc1C=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.38
TSHR P16473 3/20 0.38
ERN1 O75460 2/20 0.37
GRIA1 P42261 1/20 0.35
GRIA2 P42262 1/20 0.35
GRIA3 P42263 1/20 0.35
GRIA4 P48058 1/20 0.35
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PDE10A Q9Y233 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
KDM4E B2RXH2 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL17232515 0.76 ERN1 (0.50) ALDH1A1TSHRERN1GRIA1GRIA2
SCHEMBL14877416 0.76 ERN1 (0.56) ALDH1A1TSHRERN1GRIA1GRIA2
SCHEMBL21558308 0.75 ALDH1A1 (0.39) ALDH1A1TSHRERN1CYP1A2CYP2C19
SCHEMBL19942818 0.75 LMNA (0.45) ALDH1A1TSHRLMNACYP1A2CYP3A4
SCHEMBL14876731 0.74 ERN1 (0.54) ALDH1A1TSHRERN1GRIA1GRIA2
SCHEMBL260795 0.74 ALDH1A1 (0.53) ALDH1A1TSHRLMNACYP3A4L3MBTL1
SCHEMBL1250587 0.73 ALDH1A1 (0.41) ALDH1A1TSHRERN1LMNACYP3A4
SCHEMBL209613 0.73 ERN1 (0.46) ALDH1A1TSHRERN1GRIA1GRIA2
SCHEMBL10085458 0.73 ALDH1A1 (0.52) ALDH1A1TSHRERN1GRIA1GRIA2
SCHEMBL6553025 0.73 ALDH1A1 (0.52) ALDH1A1TSHRERN1GRIA1GRIA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2592130-B1 PHOTOCHROMIC MATERIAL MITSUBISHI GAS CHEMICAL CO (JP) 2015-01-21 EP disclosed
US-8748629-B2 Photochromic material MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2014-06-10 US disclosed
EP-2592130-A1 PHOTOCHROMIC MATERIAL Mitsubishi Gas Chemical Company, Inc. (JP) 2013-05-15 EP disclosed
US-20130102775-A1 PHOTOCHROMIC MATERIAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2013-04-25 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-20130102775-A1 PHOTOCHROMIC MATERIAL RB1, BRD4, H1-4 ALDH1A1 586/4885TSHR 2378/4885ERN1 3240/4885

“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.