SCHEMBL11443012

SCHEMBL11443012

CCCN(CC(Cl)CCl)C(=O)Sc1ccc(C)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.36
▸ EGFR P00533 1/20 0.35
▸ ERBB2 P04626 1/20 0.35
▸ MAPT P10636 7/20 0.35
▸ HPGD P15428 4/20 0.35
▸ PKM P14618 1/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ HTT P42858 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ LMNA P02545 1/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ APEX1 P27695 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ TRPM8 Q7Z2W7 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31

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
SCHEMBL11437135 0.75 ALDH1A1 (0.35) TP53EGFRERBB2MAPTALDH1A1
SCHEMBL11450853 0.75 FAAH (0.41) LMNATSHR
SCHEMBL11450855 0.75 TERT (0.40) TP53MAPTHPGDALDH1A1HTT
SCHEMBL11436576 0.70 ANPEP (0.38) TP53ALDH1A1LMNA
SCHEMBL9725704 0.69 TP53 (0.56) TP53PKMALDH1A1HTTKMT2A
SCHEMBL11450845 0.68 HDAC4 (0.40) HPGDPKMALDH1A1GAATSHR
SCHEMBL11443127 0.67 KMT2A (0.37) TP53MAPTPKMALDH1A1KMT2A
SCHEMBL11443113 0.67 ACHE (0.36) MAPT
SCHEMBL11436597 0.65 ACHE (0.36) TP53PKM
SCHEMBL11770708 0.63 TP53 (0.49) TP53ALDH1A1KMT2ALMNANPSR1

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-4213915-A FUNGICIDES, NEMATOCIDES PPG INDUSTRIES, INC. (US) 1980-07-22 — — US disclosed
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