SCHEMBL25529147

SCHEMBL25529147

CC(=O)c1nccn(-c2ccc(F)cn2)c1=O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 5/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
P2RX7 Q99572 5/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
RAB9A P51151 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
PTGS2 P35354 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
AHR P35869 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2B Q13224 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
SCHEMBL25205512 0.87 TYK2 (0.38) TYK2L3MBTL1P2RX7ALDH1A1CYP1A2
SCHEMBL30174234 0.87 TYK2 (0.38) TYK2L3MBTL1P2RX7ALDH1A1CYP1A2
SCHEMBL25533553 0.85 KDM4E (0.42) TYK2L3MBTL1P2RX7ALDH1A1RAB9A
SCHEMBL25529152 0.77 TYK2 (0.35) TYK2NPC1ALDH1A1RAB9ARXFP1
SCHEMBL25529134 0.76 L3MBTL1 (0.38) L3MBTL1NPC1ALDH1A1RAB9ARXFP1
SCHEMBL25207165 0.71 TYK2 (0.37) TYK2P2RX7AHRHRH3
SCHEMBL25208803 0.70 TYK2 (0.47) TYK2L3MBTL1P2RX7ALDH1A1CYP1A2
SCHEMBL30367326 0.70 TYK2 (0.47) TYK2L3MBTL1P2RX7ALDH1A1CYP1A2
SCHEMBL30174271 0.69 TYK2 (0.56) TYK2P2RX7ALDH1A1AHR
SCHEMBL30367362 0.69 TYK2 (0.46) TYK2ALDH1A1RAB9ACYP1A2CYP2D6

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-20230151003-A1 COMPOUNDS AND METHODS OF USE EXELIXIS INC (US) 2023-05-18 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-20230151003-A1 COMPOUNDS AND METHODS OF USE PRKACB, PRKACA, PRKX TYK2 391/4885L3MBTL1 3091/4885P2RX7 2206/4885

“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.