SCHEMBL6902310

SCHEMBL6902310

CCCCC(C=C1CCCC1)CC

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 2/20 0.30
TDP1 Q9NUW8 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
SCHEMBL2783831 0.98 TSHR (0.45) TSHRSMN1; SMN2
SCHEMBL18186752 0.77 SMN1; SMN2 (0.44) TSHRSMN1; SMN2
SCHEMBL18186751 0.77 SMN1; SMN2 (0.44) TSHRSMN1; SMN2
SCHEMBL14915013 0.73
SCHEMBL28108367 0.69 ADH1B (0.35)
SCHEMBL4281878 0.68 TSHR (0.64) TSHRSMN1; SMN2ALDH1A1TDP1
SCHEMBL4274173 0.66 TSHR (0.61) TSHRSMN1; SMN2ALDH1A1TDP1
SCHEMBL4269639 0.66 TSHR (0.61) TSHRSMN1; SMN2ALDH1A1TDP1
SCHEMBL2309309 0.66
SCHEMBL103963 0.66

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1204687-B1 SILANE ENDCAPPED MOISTURE CURABLE COMPOSITIONS GEN ELECTRIC (US) 2004-10-20 EP claimed
JP-2003508561-A 2003-03-04 JP claimed
EP-1204687-A1 SILANE ENDCAPPED MOISTURE CURABLE COMPOSITIONS Crompton Corporation (US) 2002-05-15 EP claimed
WO-2001016201-A1 SILANE ENDCAPPED MOISTURE CURABLE COMPOSITIONS CROMPTON CORPORATION (US) 2001-03-08 WO claimed
US-6197912-B1 AMINO-FUNCTIONAL SILANES OR SILOXANES; HEAT AND TEAR RESISTANCE, ELONGATION CK WITCO CORPORATION 2001-03-06 US claimed