SCHEMBL29778725

SCHEMBL29778725

Cc1cc(C)c(NC(=O)C(C)C2CCN(Cc3ccccc3)CC2)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SCN4A P35499 2/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ TP53 P04637 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ DCUN1D1 Q96GG9 1/20 0.48
▸ LMNA P02545 2/20 0.48
▸ POLB P06746 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ HTT P42858 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL29778727 0.88 SCN4A (0.50) SCN4ACYP3A4CYP2D6TP53MAPT
SCHEMBL29778752 0.87 GAA (0.60) CYP3A4CYP2D6DCUN1D1POLBGAA
Hydrochloric Acid SCHEMBL7810311 0.82 KMT2A (0.58) TP53POLB
SCHEMBL29778743 0.80 SCN4A (0.56) SCN4ACYP3A4CYP2D6LMNAGAA
SCHEMBL6750641 0.77 OPRM1 (0.54) CYP2D6
SCHEMBL7810400 0.77 ABL1 (0.56) TSHRSMN1; SMN2
Hydrochloric Acid SCHEMBL3156656 0.77 ABL1 (0.56) TSHR
SCHEMBL26096557 0.76 ABL1 (0.54) CYP2D6GAATSHR
SCHEMBL29778709 0.75 GAA (0.59) CYP3A4CYP2D6DCUN1D1POLBGAA
SCHEMBL28781788 0.74 ACHE (0.59) CYP3A4CYP2D6MAPTDCUN1D1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114763335-B 4-Amide piperidine derivative and preparation method and application thereof 江苏谛奇医药科技有限公司 2025-03-18 — — CN disclosed
CN-114763335-A 4-amide piperidine derivative and preparation method and application thereof 江苏谛奇医药科技有限公司 2022-07-19 — — CN disclosed
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