SCHEMBL11750409

SCHEMBL11750409

CNC(=O)n1nc(N)c2ccc(Cl)cc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 1/20 0.49
▸ CDK5 Q00535 1/20 0.49
▸ TYRO3 Q06418 1/20 0.49
▸ KMO O15229 1/20 0.39
▸ SCN10A Q9Y5Y9 1/20 0.39
▸ GUCY1A1 Q02108 3/20 0.36
▸ GUCY1B1 Q02153 3/20 0.36
▸ KCNH2 Q12809 2/20 0.36
▸ PIK3CD O00329 1/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ PIK3CB P42338 1/20 0.36
▸ PIK3CG P48736 1/20 0.36
▸ GAA P10253 3/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ RAB9A P51151 1/20 0.36

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
SCHEMBL11751709 0.83 PDGFRA (0.49) PDGFRACDK5TYRO3KMOGUCY1A1
SCHEMBL11752415 0.81 PDGFRA (0.42) PDGFRACDK5TYRO3ALDH1A1LMNA
SCHEMBL11749575 0.80 PDGFRA (0.49) PDGFRACDK5TYRO3KMOGAA
SCHEMBL11751308 0.78 ADORA2A (0.49) PDGFRACDK5TYRO3KMOKMT2A
SCHEMBL6480204 0.77 PDGFRA (0.46) PDGFRACDK5TYRO3KMOKMT2A
SCHEMBL11750923 0.73 ALDH1A1 (0.47) PDGFRACDK5TYRO3KMOKMT2A
SCHEMBL11745980 0.72 THRB (0.43) KMT2AALDH1A1MEN1LMNARAB9A
SCHEMBL10320957 0.72 NR4A2 (0.42) KMOALDH1A1SMN1; SMN2ADORA2AMAT2A
SCHEMBL12593994 0.71 KMO (0.49) KMOGAAKMT2AALDH1A1MEN1
SCHEMBL31032598 0.69 PLA2G4A (0.39) PDGFRACDK5TYRO3KMOPIK3CD

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
US-4051252-A ANALGESIC, ANTIINFLAMMATORY, ANTIPYRETIC BAYER AKTIENGESELLSCHAFT (DT) 1977-09-27 — — US disclosed
Send feedback