SCHEMBL25175239

SCHEMBL25175239

O=C(O)C(F)(F)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.55
POLB P06746 3/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
ALDH1A1 P00352 4/20 0.49
SIRT6 Q8N6T7 2/20 0.49
ADRB1 P08588 1/20 0.49
LMNA P02545 1/20 0.48
AKR1C3 P42330 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL25447159 0.89 MAPT (0.59) MAPTPOLBCYP2C9CYP2C19ALDH1A1
SCHEMBL10035934 0.84 POLB (0.59) MAPTPOLBCYP2C9CYP2C19ALDH1A1
SCHEMBL25176060 0.83 MAPT (0.60) MAPTPOLBCYP2C9CYP2C19ALDH1A1
SCHEMBL25169674 0.82 MAPT (0.66) MAPTPOLBCYP2C9CYP2C19ALDH1A1
SCHEMBL25176108 0.80 GFER (0.46) MAPTPOLBCYP2C9CYP2C19ALDH1A1
SCHEMBL18296386 0.79 MAPT (0.59) MAPTPOLBCYP2C9CYP2C19ALDH1A1
SCHEMBL27881 0.79 MAPT (0.70) MAPTPOLBCYP2C9CYP2C19ALDH1A1
Trifluoroacetic Acid SCHEMBL3555102 0.78 MAPT (0.49) MAPTPOLBCYP2C9CYP2C19ALDH1A1
Trifluoroacetic Acid SCHEMBL3552142 0.78 MAPT (0.49) MAPTPOLBCYP2C9CYP2C19ALDH1A1
SCHEMBL25197695 0.78 POLB (0.67) MAPTPOLBCYP2C9CYP2C19ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12559492-B2 BRAF degraders C4 THERAPEUTICS, INC. (US) 2026-02-24 US disclosed
US-20230145336-A1 BRAF DEGRADERS C4 THERAPEUTICS, INC. (US) 2023-05-11 US disclosed
US-20230145336-A1 BRAF DEGRADERS C4 THERAPEUTICS, INC. (US) 2023-05-11 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 (2 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-12559492-B2 BRAF degraders BRAF, NRAS, HRAS MAPT 4613/4885POLB 791/4885CYP2C9 2913/4885
US-20230145336-A1 BRAF DEGRADERS BRAF, NRAS, RAF1 MAPT 2440/4885POLB 698/4885CYP2C9 2770/4885

“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.