SCHEMBL7943247

SCHEMBL7943247

Cc1cc(CN(C)CCO)c(O)c(C(C)(C)C)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.58
CYP2C19 P33261 6/20 0.57
CYP2C9 P11712 5/20 0.57
HIF1A Q16665 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
CYP2D6 P10635 3/20 0.51
HSD17B10 Q99714 2/20 0.51
ALDH1A1 P00352 4/20 0.50
CA2 P00918 2/20 0.50
POLB P06746 1/20 0.50
TYR P14679 1/20 0.50
MAPK1 P28482 3/20 0.49
HTT P42858 2/20 0.49
KDM4E B2RXH2 1/20 0.49
MAPT P10636 1/20 0.49
HPGD P15428 1/20 0.49
CYP1A2 P05177 4/20 0.46
TSHR P16473 3/20 0.42
LMNA P02545 2/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL7933922 0.91 HSPA5 (0.55) HSPA5CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL7933649 0.90 HSPA5 (0.54) HSPA5CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL15222415 0.88 HSPA5 (0.58) HSPA5CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL8411161 0.86 ALDH1A1 (0.62) HSPA5CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL7942593 0.85 HIF1A (0.55) HSPA5CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL7942536 0.84 HSPA5 (0.57) HSPA5CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL7933563 0.82 HSPA5 (0.55) HSPA5CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL11002684 0.82 HSPA5 (0.68) HSPA5CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL8410735 0.81 HSPA5 (0.57) HSPA5CYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL10428273 0.80 ALDH1A1 (0.42) HSPA5CYP2C19CYP2C9HIF1ASMN1; SMN2

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-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed