SCHEMBL14280866

SCHEMBL14280866

O=C(O)/C(O)=C/c1ccc(C(F)(F)F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.53
AKR1C3 P42330 1/20 0.51
HDAC3 O15379 1/20 0.49
ADAM17 P78536 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
HDAC5 Q9UQL6 1/20 0.49
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
PTGS1 P23219 3/20 0.46
PTGS2 P35354 2/20 0.46
NQO2 P16083 1/20 0.46
SRD5A2 P31213 1/20 0.46
CYP1A1 P04798 4/20 0.45
CYP1B1 Q16678 4/20 0.45
MAOB P27338 1/20 0.45

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
SCHEMBL30587844 1.00 CYP1A2 (0.53) CYP1A2AKR1C3HDAC3ADAM17HDAC1
SCHEMBL5382427 0.84 TP53 (0.55) CYP1A2AKR1C3HDAC3ADAM17HDAC1
SCHEMBL8392279 0.82 CYP1A2 (0.52) CYP1A2AKR1C3HDAC3ADAM17HDAC1
SCHEMBL7069326 0.82 CYP1A2 (0.52) CYP1A2AKR1C3HDAC3ADAM17HDAC1
SCHEMBL7071411 0.82 CYP1A2 (0.52) CYP1A2AKR1C3HDAC3ADAM17HDAC1
SCHEMBL6933101 0.81 AKR1C3 (0.60) CYP1A2AKR1C3HDAC3ADAM17HDAC1
SCHEMBL6933104 0.81 AKR1C3 (0.60) CYP1A2AKR1C3HDAC3ADAM17HDAC1
SCHEMBL30587843 0.80 HDAC3 (0.46) CYP1A2AKR1C3HDAC3ADAM17HDAC1
SCHEMBL6669640 0.80 CYP1A2 (0.53) CYP1A2HDAC1SRD5A2
SCHEMBL6669641 0.80 CYP1A2 (0.53) CYP1A2HDAC1SRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250326718-A1 4-PHENYL-2-PYRROLIDINONES AND METHODS OF USING THEREOF UNIV NORTH CAROLINA STATE (US) 2025-10-23 US disclosed
EP-4504173-A2 4-PHENYL-2-PYRROLIDINONES AND METHODS OF USING THEREOF North Carolina State University (US) 2025-02-12 EP disclosed
WO-2023196678-A2 4-PHENYL-2-PYRROLIDINONES AND METHODS OF USING THEREOF NORTH CAROLINA STATE UNIVERSITY (US) 2023-10-12 WO disclosed
US-7317012-B2 Bicyclic heterocycles as cannabinoind-1 receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-08 US disclosed
US-7317012-B2 Bicyclic heterocycles as cannabinoind-1 receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-08 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-20250326718-A1 4-PHENYL-2-PYRROLIDINONES AND METHODS OF USING THEREOF PGLS, ALG8, PFAS CYP1A2 2205/4885AKR1C3 4764/4885HDAC3 294/4885

“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.