SCHEMBL353259

SCHEMBL353259

CNC(=O)c1ccc(C(F)(F)F)o1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MITF O75030 1/20 0.41
PLK1 P53350 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
HDAC4 P56524 2/20 0.38
HDAC6 Q9UBN7 1/20 0.38
KLK7 P49862 1/20 0.37
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 3/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
POLB P06746 2/20 0.36
GAA P10253 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL12376581 0.83 MITF (0.56) MITFPLK1HDAC6KLK7ALDH1A1
SCHEMBL13078563 0.79 ALDH1A1 (0.44) MITFSMN1; SMN2HDAC4HDAC6ALDH1A1
SCHEMBL1434936 0.76 TDP1 (0.45) SMN1; SMN2ALDH1A1POLBLMNAHPGD
SCHEMBL28182643 0.76 MAOA (0.39) HDAC4HDAC6ALDH1A1LMNA
SCHEMBL3064032 0.75 GRM8 (0.33) MITFSMN1; SMN2HDAC4HDAC6ALDH1A1
SCHEMBL15652003 0.75 LMNA (0.42) ALDH1A1KDM4EPOLBLMNAHPGD
SCHEMBL13044116 0.74 SMN1; SMN2 (0.35) MITFSMN1; SMN2HDAC4HDAC6KDM4E
SCHEMBL20188227 0.73 S1PR4 (0.54) SMN1; SMN2ALDH1A1KDM4ENPC1RAB9A
SCHEMBL2303628 0.72 KLK7 (0.66) SMN1; SMN2KLK7ALDH1A1KDM4ENPC1
SCHEMBL4146465 0.72 TDP1 (0.45) PLK1KLK7ALDH1A1KDM4ENPC1

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-8148380-B2 Antibacterial amide and sulfonamide substituted heterocyclic urea compounds CRESTONE, INC. (US) 2012-04-03 US disclosed
US-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds CRESTONE, INC. (US) 2012-01-19 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-20120015941-A1 Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds NAAA, AADAC, RPSA MITF 2435/4885PLK1 4007/4885SMN1; SMN2 2356/4885

“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.