SCHEMBL11489472

SCHEMBL11489472

CC(CCNC(C)(C)C)c1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 6/20 0.44
▸ PRKD3 O94806 1/20 0.40
▸ PRKCG P05129 1/20 0.40
▸ PRKCB P05771 1/20 0.40
▸ BRAF P15056 1/20 0.40
▸ PRKCA P17252 1/20 0.40
▸ PRKCH P24723 1/20 0.40
▸ PRKCI P41743 1/20 0.40
▸ PRKCE Q02156 1/20 0.40
▸ PRKCQ Q04759 1/20 0.40
▸ PRKCZ Q05513 1/20 0.40
▸ PRKCD Q05655 1/20 0.40
▸ PRKD1 Q15139 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.39
▸ LMNA P02545 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ HIF1A Q16665 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
SCHEMBL11606085 0.86 FFAR1 (0.39) NPSR1UTS2RKMT2A
SCHEMBL11496245 0.84 RIPK1 (0.35) LMNAADRB2RIPK1KMT2A
SCHEMBL11488016 0.82 AKT1 (0.41) AKT1ADRB2UTS2RKMT2A
SCHEMBL11496377 0.81 SLC6A4 (0.45) AKT1ADRB2UTS2R
SCHEMBL11489474 0.80 AKT1 (0.45) AKT1ADRB2UTS2R
SCHEMBL22957833 0.78 RIPK1 (0.58) NPSR1LMNARIPK1KMT2A
SCHEMBL11603164 0.77 AKT1 (0.40) AKT1ADRB2UTS2RKMT2A
SCHEMBL11494299 0.77 AKT1 (0.50) AKT1ADRB2UTS2RKMT2A
SCHEMBL24303132 0.77 GAA (0.52) NPSR1LMNATSHRHIF1AADRB2
SCHEMBL22957650 0.77 GAA (0.52) NPSR1LMNATSHRHIF1AADRB2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4239759-A Morpholino containing compounds, compositions and use thereof MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1980-12-16 — — US disclosed
US-4110447-A Anti-inflammatory (halo-4-biphenylyl)-alkanolamines MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1978-08-29 — — US disclosed
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