SCHEMBL27047553

SCHEMBL27047553

Cn1c(C(F)(F)F)cc(=O)n(-c2cc(Oc3cc(Br)ccc3OCC(=O)O)c(Cl)cc2F)c1=O

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 5/20 0.37
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP2C19 P33261 1/20 0.35
RORC P51449 1/20 0.34
TSHR P16473 3/20 0.34
TDP1 Q9NUW8 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
WDR5 P61964 1/20 0.34
AKR1B1 P15121 1/20 0.34
RECQL P46063 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PPARD Q03181 1/20 0.33
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL27044976 0.93 SMN1; SMN2 (0.36) HTTSMN1; SMN2TSHRMEN1KMT2A
SCHEMBL27047534 0.92 LMNA (0.41) PTGDR2SMN1; SMN2CYP2C19RORCTSHR
SCHEMBL27047555 0.92 PTGDR2 (0.39) PTGDR2HTTSMN1; SMN2TSHRTDP1
SCHEMBL3245244 0.90 BCAT1 (0.39) PTGDR2SMN1; SMN2CYP2C19RORCTSHR
SCHEMBL29452779 0.90 BCAT1 (0.39) PTGDR2SMN1; SMN2CYP2C19RORCTSHR
SCHEMBL27047561 0.88 BCAT2 (0.42) PTGDR2HTTSMN1; SMN2
SCHEMBL27047567 0.88 PTGDR2 (0.43) PTGDR2CYP2C19RORC
SCHEMBL10577900 0.88 PKM (0.40) PTGDR2HTTCYP2C19RORCTSHR
SCHEMBL27047548 0.87 PTGDR2 (0.35) PTGDR2HTTSMN1; SMN2TSHRTDP1
SCHEMBL7226294 0.85 FFAR1 (0.38) HTTCYP2C19RORCPPARDPKM

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-20240025862-A1 SUBSTITUTED N-PHENYLURACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2024-01-25 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-20240025862-A1 SUBSTITUTED N-PHENYLURACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES PFAS, DDT, NOTUM PTGDR2 3104/4885HTT 1607/4885SMN1; SMN2 4738/4885

“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.