SCHEMBL30197844

SCHEMBL30197844

O=C(CCl)c1ccccc1Nc1cccc(C(F)(F)F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
YAP1 P46937 1/20 1.00
TEAD4 Q15561 1/20 1.00
TEAD2 Q15562 1/20 1.00
RXFP1 Q9HBX9 7/20 0.68
LMNA P02545 1/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
MPO P05164 3/20 0.58
ALDH1A1 P00352 1/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
GRIK1 P39086 1/20 0.53
AKR1C3 P42330 1/20 0.53
AKR1C2 P52895 1/20 0.53
AURKA O14965 1/20 0.52
MAPK8 P45983 1/20 0.52
SIRT2 Q8IXJ6 1/20 0.52

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
SCHEMBL22731881 1.00 YAP1 (1.00) YAP1TEAD4TEAD2RXFP1LMNA
SCHEMBL24142302 0.88 YAP1 (0.79) YAP1TEAD4TEAD2RXFP1LMNA
SCHEMBL14853341 0.87 YAP1 (0.77) YAP1TEAD4TEAD2RXFP1LMNA
SCHEMBL29504977 0.85 MPO (0.74) YAP1TEAD4TEAD2RXFP1LMNA
SCHEMBL22719595 0.85 MPO (0.74) YAP1TEAD4TEAD2RXFP1LMNA
SCHEMBL9522037 0.85 YAP1 (0.74) YAP1TEAD4TEAD2RXFP1LMNA
Flufenamic Acid SCHEMBL17497 0.83 RXFP1 (0.75) YAP1TEAD4TEAD2RXFP1LMNA
Flufenamic Acid SCHEMBL29356958 0.83 RXFP1 (0.75) YAP1TEAD4TEAD2RXFP1LMNA
SCHEMBL22731809 0.83 YAP1 (0.71) YAP1TEAD4TEAD2RXFP1LMNA
SCHEMBL9268782 0.83 RXFP1 (0.78) YAP1TEAD4TEAD2RXFP1LMNA

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-2023277135-A1 METHOD FOR PRODUCING CELLS CONSTITUTING NASAL EPITHELIUM, AND CELL POPULATION INCLUDING CELLS CONSTITUTING NASAL EPITHELIUM OR PROGENITOR CELLS THEREOF 住友化学株式会社 2023-01-05 WO disclosed