SCHEMBL9575960

SCHEMBL9575960

CCO[Si](CCCOCCOc1ccc(CC(C)O)cc1)(OCC)OCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACB O00763 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAPK1 P28482 1/20 0.40
CASP1 P29466 1/20 0.40
KMT2A Q03164 1/20 0.40
SLCO1B3 Q9NPD5 1/20 0.40
SLCO1B1 Q9Y6L6 1/20 0.40
POLB P06746 1/20 0.38
RARB P10826 2/20 0.38
RARA P10276 1/20 0.36
HTT P42858 1/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36
ADRB2 P07550 2/20 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
SCHEMBL9575730 0.94 ACACB (0.40) ACACBSMN1; SMN2ALDH1A1LMNAPPARG
SCHEMBL9575958 0.84 ALDH1A1 (0.41) ACACBSMN1; SMN2MEN1USP2ALDH1A1
SCHEMBL9373992 0.76 KDM4E (0.54) ACACBSMN1; SMN2ALDH1A1LMNAKDM4E
SCHEMBL9575725 0.76 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1LMNAKDM4ECYP1A2
SCHEMBL9575778 0.75 LMNA (0.37) ACACBSMN1; SMN2MEN1USP2ALDH1A1
SCHEMBL11405912 0.74 MEN1 (0.48) SMN1; SMN2MEN1ALDH1A1LMNAMAPK1
SCHEMBL9064593 0.73 RARB (0.47) SMN1; SMN2LMNAPOLBRARBRARA
SCHEMBL28886878 0.73 LMNA (0.56) ACACBSMN1; SMN2MEN1LMNAKMT2A
Isopropyl Alcohol SCHEMBL9723319 0.73 ALDH1A1 (0.51) SMN1; SMN2MEN1ALDH1A1LMNAKMT2A
SCHEMBL16845224 0.73 NQO1 (0.56) ACACB

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-0281941-B1 Coreactive photoinitiators CIBA GEIGY AG (CH) 1993-12-08 EP claimed