SCHEMBL11099792

SCHEMBL11099792

Sc1ccc(-c2ccc(-n3ccnc3)cc2)nn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.54
▸ ALOX15 P16050 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ PDE3B Q13370 3/20 0.54
▸ PDE3A Q14432 3/20 0.54
▸ NPC1 O15118 1/20 0.54
▸ CASP3 P42574 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ SENP8 Q96LD8 1/20 0.54
▸ SENP7 Q9BQF6 1/20 0.54
▸ SENP6 Q9GZR1 1/20 0.54
▸ LMNA P02545 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ ENPP2 Q13822 1/20 0.49
▸ MKNK1 Q9BUB5 1/20 0.49
▸ MKNK2 Q9HBH9 1/20 0.49
▸ NOTUM Q6P988 1/20 0.49
▸ ADH5 P11766 4/20 0.48
▸ CYP3A4 P08684 1/20 0.47

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
SCHEMBL7299008 0.81 ENPP2 (0.57) MEN1ALOX15TSHRKMT2APDE3B
SCHEMBL11097731 0.78 NPC1 (0.50) MEN1ALOX15TSHRKMT2APDE3B
SCHEMBL2533488 0.77 TSHR (0.84) MEN1ALOX15TSHRKMT2APDE3B
SCHEMBL11099214 0.77 KMT2A (0.49) MEN1ALOX15TSHRKMT2APDE3B
SCHEMBL2532397 0.75 LMNA (0.78) MEN1ALOX15TSHRKMT2ALMNA
SCHEMBL11100630 0.75 CYP11B1 (0.57) MAPTCYP3A4
SCHEMBL696731 0.74 LMNA (0.64) MEN1ALOX15TSHRKMT2ALMNA
SCHEMBL11101040 0.74 PDE3B (0.57) MEN1ALOX15TSHRKMT2APDE3B
Hydrochloric Acid SCHEMBL28701756 0.73 LMNA (0.75) MEN1ALOX15TSHRKMT2ALMNA
SCHEMBL11104630 0.73 CYP3A4 (0.34) MEN1ALOX15TSHRKMT2APDE3B

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
EP-0122419-A2 Substituted 3-mercaptopyridazines, their 3-alkylthio derivatives and processes for their preparation A. Nattermann & Cie. GmbH (DE) 1984-10-24 — — EP disclosed
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