SCHEMBL25529013

SCHEMBL25529013

COC(=O)c1cccn(-c2ccc(F)cn2)c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 5/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
AHR P35869 1/20 0.41
MAPT P10636 3/20 0.40
RAB9A P51151 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP2C19 P33261 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
GAA P10253 1/20 0.38
CYP2C9 P11712 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
F10 P00742 1/20 0.38
RIPK2 O43353 1/20 0.37
MET P08581 1/20 0.37

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
SCHEMBL30367362 1.00 TYK2 (0.46) TYK2MEN1KMT2ASLC6A4SLC6A3
SCHEMBL25070118 0.85 TYK2 (0.45) TYK2MEN1KMT2AMAPTRAB9A
SCHEMBL25532209 0.85 RAB9A (0.40) TYK2KMT2AMAPTRAB9AKDM4E
SCHEMBL30367326 0.84 TYK2 (0.47) TYK2AHRMAPTKDM4EALDH1A1
SCHEMBL25208803 0.84 TYK2 (0.47) TYK2AHRMAPTKDM4EALDH1A1
SCHEMBL30174271 0.83 TYK2 (0.56) TYK2AHRKDM4EALDH1A1F10
SCHEMBL4817433 0.80 TSHR (0.56) TYK2MAPTKDM4EALDH1A1CYP2C19
SCHEMBL30367869 0.80 TSHR (0.56) TYK2MAPTKDM4EALDH1A1CYP2C19
SCHEMBL679236 0.80 MEN1 (0.61) MEN1KMT2ASLC6A4SLC6A3MAPT
SCHEMBL25533553 0.80 KDM4E (0.42) TYK2MEN1KMT2AAHRMAPT

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-20230151003-A1 COMPOUNDS AND METHODS OF USE EXELIXIS INC (US) 2023-05-18 US disclosed
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 391/4885MEN1 3817/4885KMT2A 3083/4885

“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.