SCHEMBL19159103

SCHEMBL19159103

Cc1nc(OCC(C)c2ccccc2)nc2cnccc12

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LATS1 O95835 4/20 0.41
▸ LATS2 Q9NRM7 1/20 0.38
▸ KDM4C Q9H3R0 8/20 0.37
▸ NOX1 Q9Y5S8 1/20 0.37
▸ PIP4K2A P48426 2/20 0.36
▸ NR3C1 P04150 1/20 0.35
▸ IGLV6-57 P01721 1/20 0.35
▸ USP7 Q93009 1/20 0.35
▸ DHODH Q02127 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CCR5 P51681 1/20 0.34

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
SCHEMBL17503833 0.86 LATS1 (0.40) LATS1LATS2KDM4CNOX1PIP4K2A
SCHEMBL19158281 0.77 KDM4C (0.51) LATS1LATS2KDM4CPIP4K2A
SCHEMBL19158357 0.76 KDM4C (0.40) LATS1LATS2KDM4CNOX1PIP4K2A
SCHEMBL19158870 0.76 LATS1 (0.41) LATS1LATS2KDM4CUSP7DHODH
SCHEMBL19158774 0.74 KDM4C (0.39) LATS1LATS2KDM4C
SCHEMBL19159348 0.72 ALDH1A1 (0.41) LATS1LATS2KDM4C
SCHEMBL19158161 0.70 HRH3 (0.45) LATS1LATS2KDM4C
SCHEMBL17503666 0.69 KDM4C (0.42) LATS1LATS2KDM4C
SCHEMBL19159350 0.67 LATS1 (0.45) LATS1LATS2KDM4C
SCHEMBL17503801 0.67 KDM4C (0.39) LATS1LATS2KDM4C

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-2970211-B1 HISTONE DEMETHYLASE INHIBITORS QUANTICEL PHARMACEUTICALS INC (US) 2017-07-26 — — EP disclosed
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