SCHEMBL9751088

SCHEMBL9751088

O=C(O)CCOc1ncc(Cl)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CYP2C9 P11712 1/20 0.46
TSHR P16473 1/20 0.46
APEX1 P27695 1/20 0.46
MCL1 Q07820 1/20 0.45
MAPK1 P28482 1/20 0.44
PSMB5 P28074 1/20 0.43
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PLAU P00749 2/20 0.41
LIPE Q05469 4/20 0.40
BCHE P06276 1/20 0.40
RAB9A P51151 1/20 0.40
RXRA P19793 2/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39

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
SCHEMBL20552074 0.92 RAB9A (0.48) LMNAL3MBTL1SMN1; SMN2CYP2C9TSHR
SCHEMBL9751094 0.87 LMNA (0.46) LMNAL3MBTL1SMN1; SMN2CYP2C9TSHR
SCHEMBL8684051 0.84 SMN1; SMN2 (0.65) LMNAL3MBTL1SMN1; SMN2CYP2C9TSHR
SCHEMBL11000247 0.83 TDP1 (0.53) LMNAL3MBTL1SMN1; SMN2CYP2C9TSHR
SCHEMBL29987609 0.77 LMNA (0.50) LMNAL3MBTL1SMN1; SMN2CYP2C9TSHR
SCHEMBL28617037 0.77 LMNA (0.50) LMNAL3MBTL1SMN1; SMN2CYP2C9TSHR
SCHEMBL11882534 0.77 LMNA (0.53) LMNAL3MBTL1SMN1; SMN2CYP2C9TSHR
SCHEMBL4537676 0.75 L3MBTL1 (0.49) LMNAL3MBTL1SMN1; SMN2CYP2C9TSHR
SCHEMBL15673119 0.75 LMNA (0.52) LMNAL3MBTL1SMN1; SMN2CYP2C9TSHR
SCHEMBL29848579 0.74 LMNA (0.50) LMNAL3MBTL1SMN1; SMN2CYP2C9TSHR

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-5041609-A Plant growth regulators BAYER AKTIENGESELLSCHAFT (DE) 1991-08-20 US disclosed