SCHEMBL29150408

SCHEMBL29150408

CC(C)CCCC(C)OC(=O)c1ccc(N(C)C)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.51
▸ ALDH1A1 P00352 8/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ LMNA P02545 2/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ HPGD P15428 6/20 0.44
▸ MAPT P10636 6/20 0.44
▸ RAB9A P51151 6/20 0.43
▸ NPC1 O15118 5/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ HDAC3 O15379 2/20 0.42
▸ HDAC4 P56524 2/20 0.42
▸ HDAC1 Q13547 2/20 0.42
▸ HDAC7 Q8WUI4 2/20 0.42
▸ HDAC2 Q92769 2/20 0.42
▸ HDAC10 Q969S8 2/20 0.42

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
SCHEMBL384493 0.91 ALDH1A1 (0.47) TSHRALDH1A1HSD17B10LMNACYP3A4
SCHEMBL20306424 0.88 ALDH1A1 (0.48) TSHRALDH1A1HSD17B10LMNACYP3A4
SCHEMBL38612 0.86 ALDH1A1 (0.55) TSHRALDH1A1HSD17B10LMNACYP3A4
SCHEMBL27858701 0.85 ALDH1A1 (0.53) TSHRALDH1A1HSD17B10LMNACYP3A4
SCHEMBL21834922 0.84 TSHR (0.51) TSHRALDH1A1HSD17B10MAPTKDM4E
SCHEMBL16348824 0.84 ALDH1A1 (0.54) TSHRALDH1A1HSD17B10LMNACYP3A4
SCHEMBL30829602 0.81 ALDH1A1 (0.51) TSHRALDH1A1LMNAMAPTRAB9A
SCHEMBL4266120 0.81 ALDH1A1 (0.52) TSHRALDH1A1HSD17B10LMNACYP3A4
SCHEMBL384494 0.79 ALDH1A1 (0.54) TSHRALDH1A1HSD17B10LMNACYP3A4
SCHEMBL4892599 0.78 ALDH1A1 (0.53) TSHRALDH1A1HSD17B10LMNACYP3A4

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-117255815-A Photocurable composition, cured product thereof, and display device comprising same 株式会社东进世美肯 2023-12-19 — — CN claimed
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