SCHEMBL18175980

SCHEMBL18175980

CC(C)N(C)C(=O)c1cccc(N)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PBRM1 Q86U86 1/20 0.49
▸ NPC1 O15118 1/20 0.46
▸ MITF O75030 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.42
▸ KDM4C Q9H3R0 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ ADRB2 P07550 2/20 0.42
▸ ADRB1 P08588 2/20 0.42
▸ ADRB3 P13945 2/20 0.42
▸ F2 P00734 1/20 0.42
▸ PLG P00747 1/20 0.42
▸ PRSS1 P07477 1/20 0.42
▸ PRSS2 P07478 1/20 0.42
▸ PRSS3 P35030 1/20 0.42
▸ CA1 P00915 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ CA9 Q16790 2/20 0.41
▸ MEN1 O00255 2/20 0.40

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
SCHEMBL13369998 0.84 PBRM1 (0.50) PBRM1NPC1MITFLMNAPOLB
SCHEMBL18175925 0.84 KDM4E (0.44) PBRM1NPC1MITFLMNAPOLB
SCHEMBL1172823 0.82 PBRM1 (0.55) PBRM1NPC1MITFLMNAPOLB
SCHEMBL27572329 0.82 PBRM1 (0.41) PBRM1NPC1MITFLMNAPOLB
SCHEMBL22318570 0.81 CA12 (0.50) POLBALDH1A1KDM4ECA1CA2
Hydrochloric Acid SCHEMBL27784476 0.80 PBRM1 (0.53) PBRM1NPC1MITFLMNAPOLB
SCHEMBL24766663 0.80 PBRM1 (0.46) PBRM1NPC1MITFLMNAPOLB
SCHEMBL19592399 0.79 F2 (0.42) PBRM1NPC1MITFLMNAPOLB
SCHEMBL13412201 0.79 CES2 (0.53) NPC1ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL1196746 0.79 KMT2A (0.39) MEN1KMT2AHSD17B10GAAADORA3

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-2417120-B1 SUBSTITUTED PIPERIDINES AS CCR3 ANTAGONISTS BOEHRINGER INGELHEIM INT (DE) 2016-10-26 — — EP disclosed
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