SCHEMBL11099214

SCHEMBL11099214

Cc1cc(-c2ccc(-n3ccnc3)cc2)nnc1S

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ PDE3B Q13370 3/20 0.48
▸ PDE3A Q14432 3/20 0.48
▸ ADH5 P11766 6/20 0.47
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ CASP3 P42574 1/20 0.46
▸ SENP8 Q96LD8 1/20 0.46
▸ SENP7 Q9BQF6 1/20 0.46
▸ SENP6 Q9GZR1 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ PDE2A O00408 1/20 0.45
▸ LMNA P02545 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ ENPP2 Q13822 1/20 0.44
▸ MKNK1 Q9BUB5 1/20 0.44
▸ MKNK2 Q9HBH9 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
SCHEMBL11099792 0.77 MEN1 (0.54) KMT2AMEN1ALOX15TSHRPDE3B
SCHEMBL11101040 0.75 PDE3B (0.57) KMT2AMEN1ALOX15TSHRPDE3B
SCHEMBL11097731 0.73 NPC1 (0.50) KMT2AMEN1ALOX15TSHRPDE3B
SCHEMBL2533488 0.73 TSHR (0.84) KMT2AMEN1ALOX15TSHRPDE3B
SCHEMBL19186987 0.72 KMT2A (0.70) KMT2AMEN1ALOX15TSHRPDE3B
SCHEMBL2532397 0.71 LMNA (0.78) KMT2AMEN1ALOX15TSHRADH5
SCHEMBL7299008 0.71 ENPP2 (0.57) KMT2AMEN1ALOX15TSHRPDE3B
SCHEMBL11096275 0.70 PDE3B (0.55) KMT2AMEN1ALOX15TSHRPDE3B
SCHEMBL6744620 0.70 RAB9A (0.47) KMT2AMEN1NPC1RAB9ASMN1; SMN2
SCHEMBL171705 0.69 LMNA (0.64) KMT2AMEN1ALOX15TSHRADH5

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
Send feedback