SCHEMBL30860795

SCHEMBL30860795

CC(C)(C)OC(=O)Nc1ccc(F)c2c1cnn2C1CCCCO1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.38
CYP4A11 Q02928 2/20 0.38
CYP17A1 P05093 1/20 0.37
ATR Q13535 4/20 0.36
BRAF P15056 1/20 0.35
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
RXRG P48443 1/20 0.34
CCR2 P41597 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
HTR2C P28335 1/20 0.33
SLC6A4 P31645 1/20 0.33
CNR2 P34972 1/20 0.33
EGLN2 Q96KS0 1/20 0.33
SYK P43405 1/20 0.33
P2RX3 P56373 1/20 0.33
RORC P51449 2/20 0.33
HDAC4 P56524 1/20 0.33
HDAC6 Q9UBN7 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
SCHEMBL30860896 0.89 CYP4F2 (0.39) CYP4F2CYP4A11ATRRXRARXRB
SCHEMBL30860878 0.87 ATR (0.37) CYP4F2CYP4A11ATRRXRARXRB
SCHEMBL27227973 0.84 CYP4F2 (0.45) CYP4F2CYP4A11ATRRXRARXRB
SCHEMBL31093786 0.84 CYP4F2 (0.37) CYP4F2CYP4A11CYP17A1ATRBRAF
SCHEMBL31093693 0.83 ATR (0.35) CYP4F2CYP4A11ATRBRAFHTR2C
SCHEMBL31093857 0.83 ATR (0.35) CYP4F2CYP4A11CYP17A1ATRRORC
SCHEMBL30860903 0.82 RXRA (0.42) CYP4F2CYP4A11ATRRXRARXRB
SCHEMBL31093695 0.82 ATR (0.36) CYP4F2CYP4A11CYP17A1ATRBRAF
SCHEMBL31093852 0.82 ATR (0.35) CYP4F2CYP4A11CYP17A1ATRCCR2
SCHEMBL31093803 0.81 ATR (0.33) CYP4F2CYP4A11ATRRORC

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-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. 2024-05-30 US disclosed
WO-2024073073-A2 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. (US) 2024-04-04 WO 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-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF LRRK2, MAP3K20, MAP3K5 CYP4F2 4767/4885CYP4A11 4739/4885CYP17A1 4611/4885

“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.