SCHEMBL29897705

SCHEMBL29897705

CCOc1ccc(S(=O)(=O)N2C[C@@H](C)N[C@@H](C)C2)cc1C(=O)Cl

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPC1 O15118 3/20 0.45
RAB9A P51151 1/20 0.45
ATM Q13315 1/20 0.45
TSHR P16473 2/20 0.45
KMT2A Q03164 4/20 0.43
MEN1 O00255 2/20 0.43
GAA P10253 1/20 0.42
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41

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
SCHEMBL6491185 1.00 ALDH1A1 (0.46) ALDH1A1LMNAHTTSMN1; SMN2NPC1
SCHEMBL6491181 1.00 ALDH1A1 (0.46) ALDH1A1LMNAHTTSMN1; SMN2NPC1
SCHEMBL29897709 0.90 APEX1 (0.49) ALDH1A1LMNAHTTSMN1; SMN2NPC1
SCHEMBL6490243 0.90 APEX1 (0.49) ALDH1A1LMNAHTTSMN1; SMN2NPC1
SCHEMBL6490246 0.90 APEX1 (0.49) ALDH1A1LMNAHTTSMN1; SMN2NPC1
SCHEMBL3029547 0.87 TSHR (0.56) ALDH1A1LMNAHTTSMN1; SMN2NPC1
SCHEMBL25926241 0.84 ALDH1A1 (0.41) ALDH1A1LMNAHTTSMN1; SMN2NPC1
SCHEMBL25925529 0.83 ALDH1A1 (0.41) ALDH1A1LMNAHTTSMN1; SMN2NPC1
SCHEMBL7745394 0.82 ALDH1A1 (0.53) ALDH1A1LMNAHTTSMN1; SMN2NPC1
SCHEMBL6691847 0.80 LMNA (0.44) ALDH1A1LMNAHTTSMN1; SMN2NPC1

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-113350301-B New compound traditional Chinese medicine honeyed pill for treating impotence 刘宝顺 2022-10-04 CN claimed
CN-116262118-A Application of alidenafil or salt thereof in preparation of medicines for preventing or treating ischemic brain injury 真奥金银花药业有限公司 2023-06-16 CN disclosed
CN-113350301-B New compound traditional Chinese medicine honeyed pill for treating impotence 刘宝顺 2022-10-04 CN disclosed