SCHEMBL20769698

SCHEMBL20769698

O=C(O)Cc1cn(Cc2ccncc2F)c2ccc(Cl)cc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
ICMT O60725 5/20 0.45
PPARD Q03181 2/20 0.45
AKR1C3 P42330 2/20 0.45
AKR1C2 P52895 2/20 0.45
AKR1A1 P14550 2/20 0.43
AKR1B1 P15121 2/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
KDM4C Q9H3R0 1/20 0.42
PLA2G2A P14555 1/20 0.39
AKR1C4 P17516 1/20 0.39
PTGS1 P23219 1/20 0.39
CHRM1 P11229 1/20 0.38
GALR3 O60755 1/20 0.38
NR2F2 P24468 1/20 0.38
YES1 P07947 1/20 0.38
KDR P35968 1/20 0.38

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
SCHEMBL20769685 0.84 ALDH1A1 (0.60) TBXAS1ALDH1A1LMNAICMTPPARD
SCHEMBL20769736 0.81 ALDH1A1 (0.60) TBXAS1ALDH1A1LMNAICMTPPARD
SCHEMBL20769672 0.81 AKR1C3 (0.56) TBXAS1ALDH1A1LMNAICMTPPARD
SCHEMBL20787937 0.81 LOXL2 (0.37) TBXAS1ICMTKDM4CCHRM1
SCHEMBL20769719 0.79 ALDH1A1 (0.65) TBXAS1ALDH1A1LMNAICMTPPARD
SCHEMBL20769663 0.78 ALDH1A1 (0.56) TBXAS1ALDH1A1LMNAICMTPPARD
SCHEMBL20769700 0.78 LMNA (0.75) ALDH1A1LMNAICMTPPARDPPARG
SCHEMBL20769651 0.77 ALDH1A1 (0.60) TBXAS1ALDH1A1LMNAICMTPPARD
SCHEMBL20769686 0.77 SLC22A12 (0.59) ALDH1A1LMNAICMTPPARDAKR1C3
SCHEMBL20769743 0.75 LMNA (0.82) ALDH1A1LMNAICMTPPARDPPARG

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
WO-2019046668-A1 AMIDE SUBSTITUTED THIAZOLES AS PROTEIN SECRETION INHIBITORS KEZAR LIFE SCIENCES (US) 2019-03-07 WO disclosed