SCHEMBL13510366

SCHEMBL13510366

O=Cc1nc(-c2ccccc2O)cs1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2B P41595 3/20 0.55
▸ RAB9A P51151 3/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ CASP3 P42574 1/20 0.55
▸ SENP8 Q96LD8 1/20 0.55
▸ SENP7 Q9BQF6 1/20 0.55
▸ SENP6 Q9GZR1 1/20 0.55
▸ CYP19A1 P11511 1/20 0.53
▸ GSTO1 P78417 3/20 0.52
▸ MAPT P10636 2/20 0.45
▸ ATM Q13315 1/20 0.45
▸ NPC1 O15118 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ HCRTR1 O43613 1/20 0.44
▸ USP2 O75604 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ TSHR P16473 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
SCHEMBL3193066 0.80 CYP19A1 (0.53) RAB9ASMN1; SMN2CYP19A1GSTO1MAPT
SCHEMBL1194033 0.77 RAB9A (0.80) HTR2BRAB9ASMN1; SMN2CASP3SENP8
SCHEMBL13284002 0.76 CYP19A1 (0.56) RAB9ASMN1; SMN2CYP19A1GSTO1MAPT
SCHEMBL2224538 0.75 ALDH1A1 (0.55) RAB9ASMN1; SMN2CYP19A1GSTO1MAPT
SCHEMBL6686670 0.75 TYR (0.66) HTR2BRAB9ASMN1; SMN2CASP3SENP8
SCHEMBL14098391 0.75 SMN1; SMN2 (0.61) HTR2BRAB9ASMN1; SMN2CASP3SENP8
SCHEMBL13510369 0.74 CYP19A1 (0.41) HTR2BRAB9ASMN1; SMN2CYP19A1GSTO1
SCHEMBL1093303 0.74 SMN1; SMN2 (0.60) HTR2BRAB9ASMN1; SMN2CASP3SENP8
SCHEMBL6686667 0.72 HTR2B (0.56) HTR2BRAB9ASMN1; SMN2CASP3SENP8
SCHEMBL14098383 0.72 RAB9A (0.54) HTR2BRAB9ASMN1; SMN2CASP3SENP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7642324-B2 Methods of using heterocycle-amine ligands, compositions, complexes, and catalysts SYMYX SOLUTIONS, INC. (US) 2010-01-05 — — US disclosed
US-7642324-B2 Methods of using heterocycle-amine ligands, compositions, complexes, and catalysts SYMYX SOLUTIONS, INC. (US) 2010-01-05 — — US disclosed
US-7642216-B2 Methods of using heterocycle-amine ligands, compositions, complexes, and catalysts SYMYX SOLUTIONS, INC. (US) 2010-01-05 — — US disclosed
US-7642216-B2 Methods of using heterocycle-amine ligands, compositions, complexes, and catalysts SYMYX SOLUTIONS, INC. (US) 2010-01-05 — — US disclosed
US-20090143222-A1 METHODS OF USING HETEROCYCLE-AMINE LIGANDS, COMPOSITIONS, COMPLEXES, AND CATALYSTS SYMYX TECHNOLOGIES, INC. (US) 2009-06-04 — — US disclosed
US-20090143222-A1 METHODS OF USING HETEROCYCLE-AMINE LIGANDS, COMPOSITIONS, COMPLEXES, AND CATALYSTS SYMYX TECHNOLOGIES, INC. (US) 2009-06-04 — — US disclosed
US-20090131619-A1 METHODS OF USING HETEROCYCLE-AMINE LIGANDS, COMPOSITIONS, COMPLEXES, AND CATALYSTS SYMYX TECHNOLOGIES, INC. (US) 2009-05-21 — — US disclosed
US-20090131619-A1 METHODS OF USING HETEROCYCLE-AMINE LIGANDS, COMPOSITIONS, COMPLEXES, AND CATALYSTS SYMYX TECHNOLOGIES, INC. (US) 2009-05-21 — — US disclosed
US-7387980-B2 Methods of using heterocycle-amine ligands, compositions, complexes, and catalysts SYMYX TECHNOLOGIES, INC. 2008-06-17 — — US disclosed
US-7387980-B2 Methods of using heterocycle-amine ligands, compositions, complexes, and catalysts SYMYX TECHNOLOGIES, INC. 2008-06-17 — — US disclosed
US-7256296-B2 Heterocycle-amine ligands, compositions, complexes, and catalysts SYMYX TECHNOLOGIES, INC. (US) 2007-08-14 — — US disclosed
US-7256296-B2 Heterocycle-amine ligands, compositions, complexes, and catalysts SYMYX TECHNOLOGIES, INC. (US) 2007-08-14 — — US disclosed
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