Sugi Predict

Sugi Predict / Compounds / Ethane

Ethane

Ethane

SCHEMBL28065381

CC.CCCCCCCCCCCCCCc1cc(C)cc(C)c1O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 10/20 0.49
▸ PTGS2 P35354 6/20 0.49
▸ TYR P14679 2/20 0.49
▸ CYP3A4 P08684 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ ESR1 P03372 1/20 0.41
▸ LIPG Q9Y5X9 1/20 0.40

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
SCHEMBL11801543 0.98 ALOX5 (0.50) ALOX5PTGS2TYRCYP3A4MEN1
SCHEMBL221458 0.98 ALOX5 (0.50) ALOX5PTGS2TYRCYP3A4MEN1
SCHEMBL5268694 0.98 ALOX5 (0.50) ALOX5PTGS2TYRCYP3A4MEN1
SCHEMBL296170 0.98 ALOX5 (0.50) ALOX5PTGS2TYRCYP3A4MEN1
SCHEMBL30564891 0.98 ALOX5 (0.50) ALOX5PTGS2TYRCYP3A4MEN1
SCHEMBL1021186 0.98 ALOX5 (0.50) ALOX5PTGS2TYRCYP3A4MEN1
SCHEMBL94454 0.98 ALOX5 (0.50) ALOX5PTGS2TYRCYP3A4MEN1
SCHEMBL1022048 0.96 ALOX5 (0.49) ALOX5PTGS2TYRCYP3A4MEN1
SCHEMBL30568741 0.91 HTT (0.47) ALOX5PTGS2TYRCYP3A4MEN1
SCHEMBL549360 0.91 HTT (0.47) ALOX5PTGS2TYRCYP3A4MEN1

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-104591970-B 2,4-dimethyl-6-(1-methyl-pentadecyl) preparation method of phenol 天津利安隆新材料股份有限公司 2016-06-15 — — CN disclosed