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
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