SCHEMBL11258288

SCHEMBL11258288

COC(=O)Nc1nc2ccc([S+](C)[O-])cc2[nH]1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 9/20 0.58
CYP1A2 P05177 6/20 0.58
HIF1A Q16665 5/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
KDR P35968 3/20 0.58
ALDH1A1 P00352 3/20 0.58
ABL1 P00519 2/20 0.58
CYP2C9 P11712 2/20 0.58
HTT P42858 2/20 0.58
CYP2C19 P33261 1/20 0.58
ABCC4 O15439 1/20 0.58
USP2 O75604 1/20 0.58
TUBB4A P04350 6/20 0.57
TUBB P07437 6/20 0.57
TUBA3C P0DPH7 6/20 0.57
TUBA1B P68363 6/20 0.57
TUBA4A P68366 6/20 0.57
TUBB4B P68371 6/20 0.57
TUBB3 Q13509 6/20 0.57
TUBB2A Q13885 6/20 0.57

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
SCHEMBL11258280 0.90 LMNA (0.49) LMNACYP1A2HIF1ASMN1; SMN2KDR
SCHEMBL20657154 0.86 LMNA (0.60) LMNACYP1A2HIF1ASMN1; SMN2KDR
Oxfendazole SCHEMBL29351297 0.86 LMNA (0.64) LMNACYP1A2HIF1ASMN1; SMN2KDR
Oxfendazole SCHEMBL9818561 0.86 LMNA (0.64) LMNACYP1A2HIF1ASMN1; SMN2KDR
Albendazole Oxide SCHEMBL30580728 0.84 LMNA (0.64) LMNACYP1A2HIF1ASMN1; SMN2KDR
Albendazole Oxide SCHEMBL17968582 0.84 LMNA (0.64) LMNACYP1A2HIF1ASMN1; SMN2KDR
Albendazole Oxide SCHEMBL1649240 0.84 LMNA (0.64) LMNACYP1A2HIF1ASMN1; SMN2KDR
SCHEMBL11663912 0.81 LMNA (0.54) LMNACYP1A2HIF1ASMN1; SMN2KDR
SCHEMBL11266586 0.80 LMNA (0.53) LMNACYP1A2HIF1ASMN1; SMN2KDR
SCHEMBL11402164 0.80 TUBB4A (0.76) LMNACYP1A2HIF1ASMN1; SMN2KDR

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
US-4321393-A Method for preparing 2-cyanamidobenzimidazoles or 2-cyanamidobenzoxazoles SMITHKLINE CORPORATION (US) 1982-03-23 US disclosed
US-4285878-A N-Phenyl-N'-cyano-O-phenylisoureas SMITHKLINE CORPORATION (US) 1981-08-25 US disclosed