SCHEMBL30439628

SCHEMBL30439628

CCCCCC(=Cc1ccccc1)CCCCC

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.64
TDP1 Q9NUW8 1/20 0.62
CES2 O00748 2/20 0.46
CES1 P23141 2/20 0.46
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
EGFR P00533 1/20 0.41
EPHX2 P34913 1/20 0.41
SOAT2 O75908 1/20 0.41
SOAT1 P35610 1/20 0.41
TUBB4A P04350 2/20 0.40
TUBB P07437 2/20 0.40
TUBA3C P0DPH7 2/20 0.40
TUBA1B P68363 2/20 0.40
TUBA4A P68366 2/20 0.40
TUBB4B P68371 2/20 0.40
TUBB3 Q13509 2/20 0.40
TUBB2A Q13885 2/20 0.40
TUBB8 Q3ZCM7 2/20 0.40
TUBA3E Q6PEY2 2/20 0.40

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
SCHEMBL28702570 0.98 TDP1 (0.65) LMNATDP1CES2CES1MEN1
SCHEMBL27498332 0.98 TDP1 (0.65) LMNATDP1CES2CES1MEN1
SCHEMBL30439792 0.98 TDP1 (0.65) LMNATDP1CES2CES1MEN1
SCHEMBL30225789 0.98 TDP1 (0.65) LMNATDP1CES2CES1MEN1
SCHEMBL8741682 0.98 LMNA (0.62) LMNATDP1CES2CES1MEN1
SCHEMBL28297913 0.98 TDP1 (0.65) LMNATDP1CES2CES1MEN1
SCHEMBL10899485 0.96 TDP1 (0.63) LMNATDP1CES2CES1MEN1
SCHEMBL93497 0.94 LMNA (0.56) LMNATDP1CES2CES1MEN1
SCHEMBL6859722 0.92 LMNA (0.60) LMNATDP1CES2CES1MEN1
SCHEMBL1171617 0.91 LMNA (0.58) LMNATDP1CES2CES1MEN1

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
CN-116391001-A Curable composition and cured product thereof 日产化学株式会社 2023-07-04 CN disclosed