SCHEMBL6135938

SCHEMBL6135938

C=CCC(C(=O)c1cccs1)C(=O)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.46
TSHR P16473 2/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
KEAP1 Q14145 1/20 0.41
MMP2 P08253 1/20 0.40
MMP3 P08254 1/20 0.40
MMP7 P09237 1/20 0.40
ALDH1A1 P00352 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
CTNNB1 P35222 1/20 0.39
WNT3A P56704 1/20 0.39
SMN1; SMN2 Q16637 2/20 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
SCHEMBL5873170 0.80 CYP2C19 (0.47) CYP2C19TSHRCYP2D6CYP2C9CES2
SCHEMBL1681118 0.76 TSHR (0.51) CYP2C19TSHRCYP2D6CYP2C9CES2
SCHEMBL28376224 0.74 TSHR (0.50) CYP2C19TSHRCYP2D6CYP2C9CES2
SCHEMBL3249145 0.73 CYP2C9 (0.52) CYP2C19TSHRCYP2D6CYP2C9CES2
SCHEMBL5873224 0.73 TSHR (0.49) CYP2C19TSHRCYP2D6CYP2C9CES2
SCHEMBL10457332 0.73 GRIK1 (0.32) CYP2C19ALDH1A1POLBSMN1; SMN2
SCHEMBL13898262 0.72 POLB (0.42) TSHRCES2CES1ALDH1A1NPC1
SCHEMBL10628291 0.72 TSHR (0.48) CYP2C19TSHRCYP2D6CYP2C9CES2
SCHEMBL28827014 0.72 CYP2C19 (0.51) CYP2C19TSHRCYP2D6CYP2C9CES2
SCHEMBL2802204 0.71 TSHR (0.50) CYP2C19TSHRCYP2D6CYP2C9CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504046-B2 Polymer grafted alkaline earth aluminate phosphor through coordination bond DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2009-03-17 US disclosed
US-7504046-B2 Polymer grafted alkaline earth aluminate phosphor through coordination bond DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2009-03-17 US disclosed
US-20070221886-A1 Polymer grafted alkali earth aluminate phosphor through coordination bond DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2007-09-27 US disclosed
US-20070221886-A1 Polymer grafted alkali earth aluminate phosphor through coordination bond DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2007-09-27 US disclosed
EP-1405892-B1 RED FLUORESCENT MATERIAL AND COMPOSITION CONTAINING THE SAME NIPPON KAYAKU KK (JP) 2005-11-16 EP disclosed
US-20050011405-A1 Red fluorescent material and composition containing the same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2005-01-20 US disclosed
EP-1405892-A1 RED FLUORESCENT MATERIAL AND COMPOSITION CONTAINING THE SAME Nippon Kayaku Kabushiki Kaisha (JP) 2004-04-07 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-20050011405-A1 Red fluorescent material and composition containing the same IK, HNRNPL, HNRNPA0 CYP2C19 1895/4885TSHR 4326/4885CYP2D6 3068/4885

“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.