SCHEMBL25733751

SCHEMBL25733751

C=C(CS)NC(C)CCC

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
LMNA P02545 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
THRB P10828 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TSHR P16473 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
SCHEMBL25733768 0.83 TAS1R3 (0.36) ALDH1A1NPC1RAB9A
SCHEMBL25738439 0.76 TAS1R3 (0.33)
SCHEMBL6859346 0.74 POLB (0.51) ALDH1A1HPGDPOLBKMT2ANPC1
SCHEMBL20183115 0.73
SCHEMBL20183084 0.73
SCHEMBL15026782 0.70 ALDH1A1 (0.40) ALDH1A1HPGDPOLBKMT2ANPC1
SCHEMBL3895203 0.68
SCHEMBL8435511 0.68
SCHEMBL472264 0.68 TGFBR1 (0.46) ALDH1A1HPGDPOLBKMT2ANPC1
SCHEMBL2823638 0.67 ALDH1A1 (0.48) ALDH1A1HPGDPOLBKMT2ANPC1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023109932-A1 DSRNA AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海拓界生物医药科技有限公司 2023-06-22 WO disclosed
WO-2023109938-A1 DSRNA, PREPARATION METHOD THEREFOR AND USE THEREOF 上海拓界生物医药科技有限公司 2023-06-22 WO disclosed
WO-2023109935-A1 DSRNA, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海拓界生物医药科技有限公司 2023-06-22 WO disclosed
WO-2023109945-A1 DSRNA, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海拓界生物医药科技有限公司 2023-06-22 WO disclosed