SCHEMBL27399356

SCHEMBL27399356

C=CC(=C)N1CC(/C=C/c2ccc(C(F)(F)F)cn2)C1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ ABL1 P00519 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HRH3 Q9Y5N1 3/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SCN9A Q15858 5/20 0.32
▸ F13A1 P00488 1/20 0.32
▸ TGM2 P21980 1/20 0.32
▸ TGM1 P22735 1/20 0.32
▸ LIPE Q05469 2/20 0.32
▸ SCN10A Q9Y5Y9 1/20 0.32
▸ HCRTR1 O43613 2/20 0.32
▸ HCRTR2 O43614 2/20 0.32
▸ TEAD1 P28347 2/20 0.32
▸ HPGD P15428 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ LIPG Q9Y5X9 1/20 0.31
▸ GABRA1 P14867 1/20 0.31
▸ ADRA2C P18825 1/20 0.31
▸ HTR2A P28223 1/20 0.31

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
SCHEMBL30835888 0.88 TEAD1 (0.42) HRH3TEAD1HPGDSMN1; SMN2
SCHEMBL27401246 0.88 TEAD1 (0.42) HRH3TEAD1HPGDSMN1; SMN2
SCHEMBL30835927 0.77 RORC (0.43) HRH3SCN9ALIPEHCRTR1HCRTR2
SCHEMBL27401285 0.77 RORC (0.43) HRH3SCN9ALIPEHCRTR1HCRTR2
Trifluoroacetic Acid SCHEMBL30835928 0.69 KMT2A (0.38) KDM4EABL1LMNAKMT2ASCN9A
SCHEMBL265343 0.69 KMT2A (0.43) KDM4EKMT2ATGM2HPGDSMN1; SMN2
SCHEMBL27399148 0.68 TEAD1 (0.47) HRH3TEAD1
SCHEMBL15435161 0.67 KMT2A (0.46) KDM4EABL1LMNAKMT2AHPGD
SCHEMBL955290 0.67 KMT2A (0.42) KDM4EKMT2AHPGDSMN1; SMN2
SCHEMBL955289 0.67 KMT2A (0.42) KDM4EKMT2AHPGDSMN1; SMN2

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-2024059317-A1 YAP/TAZ-TEAD ONCOPROTEINS INHIBITORS BRIDGENE BIOSCIENCES, INC. (US) 2024-03-21 — — WO disclosed
Send feedback