SCHEMBL10648447

SCHEMBL10648447

O=c1ccc(-c2ccc(-n3cccn3)s2)n[nH]1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.41
▸ PDE3A Q14432 3/20 0.37
▸ PDE3B Q13370 2/20 0.37
▸ KMT2A Q03164 5/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ POLB P06746 3/20 0.36
▸ PKM P14618 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ LMNA P02545 3/20 0.36
▸ CASP6 P55212 1/20 0.35
▸ PDE5A O76074 1/20 0.34
▸ GPR119 Q8TDV5 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ GALR3 O60755 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPK1 P28482 1/20 0.32

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
SCHEMBL10648014 0.78 PDE3B (0.41) PDE3APDE3BGPR119
SCHEMBL10651151 0.78 PDE3B (0.37) CYP1A2PDE3APDE3BKMT2AMEN1
SCHEMBL10647923 0.75 CYP1A2 (0.38) CYP1A2PDE3APDE3BKMT2AMEN1
SCHEMBL30193794 0.72 LMNA (0.44) CYP1A2PDE3APDE3BKMT2AMEN1
SCHEMBL13464837 0.69 KMT2A (0.55) CYP1A2PDE3APDE3BKMT2AMEN1
SCHEMBL10650151 0.68 CYP1A2 (0.41) CYP1A2PDE3APDE3BKMT2AMEN1
SCHEMBL10646960 0.67 HTT (0.39) CYP1A2PDE3APDE3BKMT2AMEN1
SCHEMBL9807575 0.67 LMNA (0.40) RAB9ALMNAKDM4EALDH1A1
SCHEMBL10645494 0.66 ALDH1A1 (0.50) KMT2AMEN1POLBPKMLMNA
SCHEMBL18331573 0.65 NOTUM (0.40) KMT2AMEN1RAB9ALMNAKDM4E

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
EP-0128502-B1 SUBSTITUTED 6-(THIEN-2-YL)-3(2H)-PYRIDAZINONES AND PROCESSES FOR THEIR PREPARATION A. Nattermann & Cie. GmbH (DE) 1988-08-31 — — EP disclosed
EP-0128502-A1 Substituted 6-(thien-2-yl)-3(2H)-pyridazinones and processes for their preparation A. Nattermann & Cie. GmbH (DE) 1984-12-19 — — EP disclosed
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