SCHEMBL7772629

SCHEMBL7772629

Nc1cc(C(=O)NS)n[nH]1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HDAC3 O15379 1/20 0.36
▸ HDAC4 P56524 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC7 Q8WUI4 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ HDAC10 Q969S8 1/20 0.36
▸ HDAC11 Q96DB2 1/20 0.36
▸ HDAC8 Q9BY41 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ HDAC9 Q9UKV0 1/20 0.36
▸ HDAC5 Q9UQL6 1/20 0.36
▸ ALPL P05186 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ CYTH3 O43739 1/20 0.34
▸ BTK Q06187 1/20 0.34
▸ EPN1 Q9Y6I3 1/20 0.34
▸ HCAR2 Q8TDS4 4/20 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
SCHEMBL12694613 0.81 BAZ2B (0.41) MEN1KMT2AHDAC3HDAC4HDAC1
SCHEMBL4708946 0.75 — —
SCHEMBL930682 0.75 — —
SCHEMBL19185146 0.75 MAOB (0.46) MEN1KMT2AHDAC3HDAC4HDAC1
SCHEMBL2049762 0.75 HPGD (0.52) RAB9ANPC1HPGD
SCHEMBL19638915 0.74 HDAC3 (0.47) KMT2AHDAC3HDAC4HDAC1HDAC7
SCHEMBL12270026 0.74 — —
SCHEMBL1009738 0.73 MAPK1 (0.65) MEN1KMT2AALPLMAPTMAPK1
Hydrochloric Acid SCHEMBL17512686 0.73 HDAC3 (0.46) KMT2AHDAC3HDAC4HDAC1HDAC7
Hydrochloric Acid SCHEMBL14785045 0.72 MAPK1 (0.62) MEN1KMT2AALPLMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1131300-A2 METHOD FOR PRODUCING 5-AMINO-3-(THIO)CARBAMOYLPYRAZOLES Bayer Aktiengesellschaft (DE) 2001-09-12 — — EP claimed
WO-2000031043-A2 METHOD FOR PRODUCING 5-AMINO-3-(THIO)CARBAMOYLPYRAZOLES BAYER AKTIENGESELLSCHAFT (DE) 2000-06-02 — — WO claimed
CN-1326446-A Method for producing 5-Amino-3-(thio) carbamoylpyrazoles BAYER AG (DE) 2001-12-12 — — CN disclosed
EP-1131300-A2 METHOD FOR PRODUCING 5-AMINO-3-(THIO)CARBAMOYLPYRAZOLES Bayer Aktiengesellschaft (DE) 2001-09-12 — — EP disclosed
EP-1131300-A2 METHOD FOR PRODUCING 5-AMINO-3-(THIO)CARBAMOYLPYRAZOLES Bayer Aktiengesellschaft (DE) 2001-09-12 — — EP disclosed
WO-2000031043-A3 METHOD FOR PRODUCING 5-AMINO-3-(THIO)CARBAMOYLPYRAZOLES BAYER AG (DE) 2000-11-09 — — WO disclosed
WO-2000031043-A2 METHOD FOR PRODUCING 5-AMINO-3-(THIO)CARBAMOYLPYRAZOLES BAYER AKTIENGESELLSCHAFT (DE) 2000-06-02 — — WO disclosed
WO-2000031043-A2 METHOD FOR PRODUCING 5-AMINO-3-(THIO)CARBAMOYLPYRAZOLES BAYER AKTIENGESELLSCHAFT (DE) 2000-06-02 — — WO disclosed
Send feedback