SCHEMBL29624737

SCHEMBL29624737

Cc1ccc(S(=O)(=O)Nc2ccccc2C#Cc2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC16A3 O15427 7/20 0.64
▸ LMNA P02545 3/20 0.59
▸ CYP2C9 P11712 2/20 0.59
▸ CYP2C19 P33261 2/20 0.59
▸ USP2 O75604 1/20 0.59
▸ ALDH1A1 P00352 1/20 0.59
▸ POLB P06746 1/20 0.59
▸ MAPT P10636 1/20 0.59
▸ NOD2 Q9HC29 1/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.59
▸ CA2 P00918 3/20 0.57
▸ CA9 Q16790 3/20 0.57
▸ CA12 O43570 2/20 0.57
▸ MCOLN3 Q8TDD5 1/20 0.57
▸ KEAP1 Q14145 1/20 0.55
▸ NFE2L2 Q16236 1/20 0.55
▸ CA1 P00915 2/20 0.55
▸ CA4 P22748 1/20 0.55
▸ CA7 P43166 1/20 0.55
▸ TSHR P16473 1/20 0.52

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
SCHEMBL28375872 1.00 SLC16A3 (0.64) SLC16A3LMNACYP2C9CYP2C19USP2
SCHEMBL28929932 0.96 SLC16A3 (0.65) SLC16A3LMNACYP2C9CYP2C19USP2
SCHEMBL30100593 0.96 SLC16A3 (0.65) SLC16A3LMNACYP2C9CYP2C19USP2
SCHEMBL22134737 0.94 SLC16A3 (0.71) SLC16A3LMNACYP2C9CYP2C19USP2
SCHEMBL30100595 0.90 SLC16A3 (0.76) SLC16A3LMNAALDH1A1CA2CA9
SCHEMBL28929924 0.90 SLC16A3 (0.76) SLC16A3LMNAALDH1A1CA2CA9
SCHEMBL30100612 0.89 SLC16A3 (0.55) SLC16A3LMNACYP2C9CYP2C19USP2
SCHEMBL28370447 0.89 SLC16A3 (0.58) SLC16A3LMNACYP2C9CYP2C19USP2
SCHEMBL30100594 0.89 SLC16A3 (0.58) SLC16A3LMNACYP2C9CYP2C19USP2
SCHEMBL28929927 0.89 SLC16A3 (0.55) SLC16A3LMNACYP2C9CYP2C19USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115433170-A Synthetic method of indole carbon glycoside compound 江西师范大学 2022-12-06 — — CN disclosed
CN-110938027-B Synthetic method of indole derivatives 河北凯诺中星科技有限公司 2022-11-25 — — CN disclosed
CN-112321481-B Chiral indole compound and preparation method thereof 杭州师范大学 2022-06-10 — — CN disclosed
Send feedback