SCHEMBL9313175

SCHEMBL9313175

COC(CCCNC(=O)c1ccc2c(c1)C(=O)N(CCCC(OC)OC)C2=O)OC

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.60
▸ ALDH1A1 P00352 10/20 0.53
▸ TSHR P16473 2/20 0.53
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ GAA P10253 1/20 0.48
▸ CACNA1G O43497 4/20 0.48
▸ PKM P14618 1/20 0.46

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
SCHEMBL14944807 0.79 RAB9A (0.58) RAB9AALDH1A1TSHRMEN1KMT2A
SCHEMBL9616660 0.79 RAB9A (0.58) RAB9AALDH1A1TSHRMEN1KMT2A
SCHEMBL9313528 0.78 ALDH1A1 (0.64) RAB9AALDH1A1TSHRPOLB
SCHEMBL9313118 0.76 SMN1; SMN2 (0.62) ALDH1A1MEN1KMT2AGAA
SCHEMBL29678473 0.74 MAPT (0.53) RAB9AMEN1KMT2A
SCHEMBL5663071 0.74 MAPT (0.53) RAB9AMEN1KMT2A
SCHEMBL16213694 0.71 ALDH1A1 (0.54) RAB9AALDH1A1TSHRPOLB
SCHEMBL9800366 0.70 TDP1 (0.51) RAB9AMEN1KMT2A
SCHEMBL13003186 0.70 SMN1; SMN2 (0.57) RAB9AALDH1A1TSHRMEN1KMT2A
SCHEMBL16213688 0.70 ALDH1A1 (0.53) RAB9AALDH1A1TSHRPOLB

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-5360876-A Formaldehyde-free BURGOYNE JR WILLIAM F (US) 1994-11-01 — — US disclosed
US-5336807-A Diurea-,-carbamate- or -amide-containing acetal compounds; stable as solids or liquids; replace formaldehyde-containing resin crosslinkers in adhesives and coatings AIR PRODUCTS & CHEMICALS, INC. (US) 1994-08-09 — — US disclosed
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