SCHEMBL11479764

SCHEMBL11479764

O=S(=O)(Cc1ccccc1)Nc1ccnc(Sc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ HPGD P15428 2/20 0.51
▸ AR P10275 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ CYP19A1 P11511 1/20 0.45
▸ PGR P06401 1/20 0.45
▸ GLO1 Q04760 1/20 0.43
▸ BRD4 O60885 2/20 0.43
▸ PTPN2 P17706 1/20 0.43
▸ PTPN1 P18031 1/20 0.43
▸ PTPN5 P54829 1/20 0.43
▸ SGK1 O00141 1/20 0.42
▸ IMPDH2 P12268 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
SCHEMBL28823850 0.78 HPGD (0.53) KDM4EALDH1A1HPGDARKMT2A
SCHEMBL14875894 0.75 HDAC1 (0.56) KDM4EALDH1A1HPGDARKMT2A
SCHEMBL14875819 0.74 ALDH1A1 (0.52) KDM4EALDH1A1HPGDARKMT2A
SCHEMBL18135116 0.74 HPGD (0.52) KDM4EALDH1A1HPGDARKMT2A
SCHEMBL14876043 0.72 HPGD (0.46) KDM4EALDH1A1HPGDARKMT2A
SCHEMBL633995 0.71 KMT2A (0.76) KDM4EALDH1A1HPGDARKMT2A
SCHEMBL18135095 0.70 HPGD (0.47) KDM4EALDH1A1HPGDARKMT2A
SCHEMBL2725642 0.70 HTR6 (0.59) KDM4EALDH1A1HPGDARKMT2A
SCHEMBL6984395 0.69 GLO1 (0.56) KDM4EALDH1A1HPGDARKMT2A
SCHEMBL6982951 0.69 GLO1 (0.56) KDM4EALDH1A1HPGDARKMT2A

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
US-4237300-A CHEMICAL INTERMEDIATES FOR IMIDAZO(1,2-A)PYRIDINE ANTHELMINTIC AGENTS AS WELL AS BEING A FUNGICIDE MERCK & CO., INC. (US) 1980-12-02 — — US disclosed
US-4177274-A ANTHELMINTICS MERCK & CO., INC. (US) 1979-12-04 — — US disclosed
US-4096264-A ANTHELMINTICS MERCK & CO., INC. (US) 1978-06-20 — — US disclosed
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