SCHEMBL18924009

SCHEMBL18924009

C=C(C#N)C(=O)OCCCCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
NPC1 O15118 1/20 0.46
RECQL P46063 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NAAA Q02083 3/20 0.45
FFAR1 O14842 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
MAPT P10636 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
TDP1 Q9NUW8 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
SCHEMBL4889770 0.89 HCAR2 (0.47) LMNANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL28444213 0.81 LMNA (0.56) LMNANPC1RECQLRAB9ASMN1; SMN2
SCHEMBL7263670 0.81 LMNA (0.68) LMNANPC1RECQLRAB9ASMN1; SMN2
SCHEMBL4580407 0.80 TSHR (0.63) NAAAALDH1A1TSHRTDP1
SCHEMBL146245 0.80 POLB (0.55) LMNANPC1RECQLRAB9ASMN1; SMN2
SCHEMBL1603035 0.80 ALDH1A1 (0.50) LMNASMN1; SMN2ALDH1A1TSHRTDP1
SCHEMBL232155 0.79 POLB (0.57) LMNANPC1RECQLRAB9ASMN1; SMN2
SCHEMBL233287 0.79 POLB (0.57) LMNANPC1RECQLRAB9ASMN1; SMN2
SCHEMBL1562514 0.79 POLB (0.57) LMNANPC1RECQLRAB9ASMN1; SMN2
SCHEMBL342384 0.79 POLB (0.57) LMNANPC1RECQLRAB9ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9670145-B2 Process for preparing 1,1-disubstituted ethylene monomers AFINITICA TECHNOLOGIES, S. L. (ES) 2017-06-06 US disclosed