Bumetrizole

Bumetrizole

SCHEMBL8359542

Cc1cc(-n2nc3ccc(Cl)cc3n2)c(O)c(C(C)(C)C)c1.Cln1nnc2ccccc21

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ POLB P06746 3/20 0.40
▸ LMNA P02545 1/20 0.38
▸ ATM Q13315 2/20 0.36
▸ SMN1; SMN2 Q16637 4/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ TSHR P16473 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ CRHBP P24387 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ CRHR2 Q13324 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ CASP3 P42574 1/20 0.33
▸ KMT2A Q03164 1/20 0.33

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
Bumetrizole SCHEMBL6068328 0.89 NPC1 (0.60) NPC1RAB9APOLBLMNAATM
Bumetrizole SCHEMBL1792777 0.87 KCNMA1 (0.48) NPC1RAB9APOLBLMNAATM
Bumetrizole SCHEMBL8054070 0.85 NPC1 (0.53) NPC1RAB9APOLBLMNAATM
Bumetrizole SCHEMBL29353083 0.85 NPC1 (0.53) NPC1RAB9APOLBLMNAATM
Bumetrizole SCHEMBL23734 0.85 NPC1 (0.53) NPC1RAB9APOLBLMNAATM
Bumetrizole SCHEMBL2398487 0.85 NPC1 (0.53) NPC1RAB9APOLBLMNAATM
Bumetrizole SCHEMBL8056551 0.85 NPC1 (0.53) NPC1RAB9APOLBLMNAATM
Bumetrizole SCHEMBL8603228 0.85 NPC1 (0.53) NPC1RAB9APOLBLMNAATM
Bumetrizole SCHEMBL9301984 0.84 NPC1 (0.52) NPC1RAB9APOLBLMNAATM
Bumetrizole SCHEMBL9273939 0.84 NPC1 (0.52) NPC1RAB9APOLBLMNAATM

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
US-5866658-A DISPERSED IN A CONTINUOUS OR CO-CONTINUOUS POLYAMIDE PHASE, MOLDED PARTS WHERE TOUGHNESS, HIGH GLOSS, ABRASION/SCRATCH (MAR) RESISTANCE, UV RESISTANCE, HIGH TEMPERATURE PROPERTIES AND STIFFNESS ARE DESIRED. E. I. DU PONT DE NEMOURS AND COMPANY (US) 1999-02-02 — — US disclosed
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