SCHEMBL31182003

SCHEMBL31182003

O=C(C1=CS(=O)(=O)c2ccccc21)N1CCN(C(=O)c2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.49
ALDH1A1 P00352 3/20 0.48
USP2 O75604 1/20 0.48
BLM P54132 1/20 0.47
SIGMAR1 Q99720 1/20 0.46
POLB P06746 3/20 0.46
LMNA P02545 1/20 0.46
TSHR P16473 2/20 0.46
MAOB P27338 1/20 0.46
ALOX15 P16050 1/20 0.45
HSD17B10 Q99714 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
ACHE P22303 1/20 0.44

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
SCHEMBL31182001 1.00 HPGD (0.49) HPGDALDH1A1USP2BLMSIGMAR1
SCHEMBL31182011 0.87 ALDH1A1 (0.53) HPGDALDH1A1USP2POLBTSHR
SCHEMBL31182016 0.83 MEN1 (0.57) HPGDTSHR
SCHEMBL31181983 0.78 HPGD (0.42) HPGDALDH1A1LMNAACHE
SCHEMBL31182013 0.77 WNT1 (0.51) POLB
SCHEMBL7129676 0.76 HPGD (0.79) HPGDALDH1A1USP2BLMSIGMAR1
SCHEMBL252026 0.76 HPGD (0.79) HPGDALDH1A1USP2BLMSIGMAR1
Hydrochloric Acid SCHEMBL1597472 0.74 HPGD (0.76) HPGDALDH1A1USP2BLMSIGMAR1
SCHEMBL4143496 0.71 POLB (0.80) HPGDALDH1A1USP2BLMSIGMAR1
SCHEMBL9410748 0.71 HPGD (0.66) HPGDALDH1A1USP2BLMSIGMAR1

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-118878508-A DC-Rhoin derivative, preparation method and application thereof 广东省中医院(广州中医药大学第二附属医院、广州中医药大学第二临床医学院、广东省中医药科学院) 2024-11-01 CN disclosed