SCHEMBL9790282

SCHEMBL9790282

CCC(C=O)CC.COC(C)OC

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GAPDH P04406 1/20 0.30

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
SCHEMBL9790279 0.83 TSHR (0.73) TSHRSMN1; SMN2
SCHEMBL29715 0.81
SCHEMBL9659853 0.80 TSHR (0.52) TSHRSMN1; SMN2
2-Methylbutanal SCHEMBL9790338 0.80 TSHR (0.30) TSHRSMN1; SMN2
SCHEMBL3074987 0.78 LMNA (0.57) TSHRSMN1; SMN2
SCHEMBL10786843 0.78
SCHEMBL10923089 0.78
SCHEMBL8405269 0.78
SCHEMBL5618574 0.76
Propionaldehyde SCHEMBL1412137 0.76 ALDH1A1 (0.53)

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-4983501-A Water-insoluble binder, compound forming strong acid on irradiation, acetal, relief image formation HOECHST AKTIENGESELLSCHAFT (DE) 1991-01-08 US disclosed