SCHEMBL9799605

SCHEMBL9799605

CCC#CCCCCCCC[CH]CCCCCCCCC#CCC

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.37
PTPN7 P35236 3/20 0.34
HMGCR P04035 3/20 0.34
RECQL P46063 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL7638150 0.93 HMGCR (0.39) RAB9APTPN7HMGCRRECQLTDP1
SCHEMBL6697624 0.89 RAB9A (0.31) RAB9A
SCHEMBL31336402 0.84 RAB9A (0.48) RAB9APTPN7HMGCRRECQLTDP1
SCHEMBL9208114 0.83 RAB9A (0.36) RAB9APTPN7HMGCRRECQLTDP1
SCHEMBL6319883 0.83 PTPN7 (0.47) PTPN7HMGCRRECQLTDP1
SCHEMBL7179774 0.81 PTPN7 (0.45) PTPN7HMGCRRECQLTDP1
SCHEMBL3621240 0.81 RAB9A (0.43) RAB9APTPN7HMGCRRECQLTDP1
SCHEMBL2121380 0.80 RAB9A (0.32) RAB9APTPN7HMGCR
SCHEMBL31336313 0.78 TSHR (0.48) RAB9APTPN7HMGCRRECQLTDP1
SCHEMBL5857246 0.78 TSHR (0.48) RAB9A

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-5047169-A ELEVATES REFRACTIVE INDEX ANISOTROPY OF LIFQUID CRYSTAL COMPOUNDS; HIGH SPEED RESPONSE ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1991-09-10 US disclosed