SCHEMBL28100016

SCHEMBL28100016

CC[CH]CC(CCCCCC)CCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
ADH1B P00325 1/20 0.42
ADH1C P00326 1/20 0.42
ADH1A P07327 1/20 0.42
ADH4 P08319 1/20 0.42
ADH7 P40394 1/20 0.42
DNM1 Q05193 2/20 0.39
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
OPRM1 P35372 1/20 0.37
GPR84 Q9NQS5 3/20 0.35
FDPS P14324 3/20 0.35
SPHK1 Q9NYA1 1/20 0.35
FFAR1 O14842 1/20 0.35
ALDH1A1 P00352 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL10412954 1.00 LMNA (0.50) LMNAADH1BADH1CADH1AADH4
SCHEMBL28100162 0.95 LMNA (0.44) LMNAADH1BADH1CADH1AADH4
SCHEMBL9210989 0.91 LMNA (0.46) LMNAADH1BADH1CADH1AADH4
SCHEMBL100272 0.90 LMNA (0.54) LMNAADH1BADH1CADH1AADH4
SCHEMBL100837 0.90 LMNA (0.54) LMNAADH1BADH1CADH1AADH4
SCHEMBL7758121 0.86 ALDH1A1 (0.39) LMNADNM1TSHRALDH1A1TDP1
SCHEMBL17963049 0.84 LMNA (0.48) LMNAADH1BADH1CADH1AADH4
SCHEMBL844984 0.84 LMNA (0.48) LMNAADH1BADH1CADH1AADH4
SCHEMBL11250959 0.84 LMNA (0.48) LMNAADH1BADH1CADH1AADH4
SCHEMBL21834201 0.84 LMNA (0.48) LMNAADH1BADH1CADH1AADH4

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
CN-103619987-B Color converter 巴斯夫欧洲公司 2016-11-16 CN disclosed