SCHEMBL9706202

SCHEMBL9706202

CCN(CC)CCOc1cccc(N(CC)CC)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.61
▸ TSHR P16473 1/20 0.61
▸ ESR1 P03372 2/20 0.52
▸ KMT2A Q03164 3/20 0.51
▸ MAPT P10636 2/20 0.51
▸ CHRNA7 P36544 1/20 0.51
▸ HTT P42858 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ LTA4H P09960 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ THRB P10828 1/20 0.48
▸ POLB P06746 1/20 0.47
▸ SMARCA2 P51531 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ MAOB P27338 1/20 0.47

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
SCHEMBL7449633 0.88 ALDH1A1 (0.53) KDM4ETSHRKMT2AMAPTALDH1A1
SCHEMBL1428123 0.87 KDM4E (0.61) KDM4ETSHRESR1KMT2AMAPT
SCHEMBL9116618 0.86 ALDH1A1 (0.52) KDM4ETSHRKMT2AMAPTALDH1A1
SCHEMBL7451458 0.86 ALDH1A1 (0.52) KDM4ETSHRKMT2AMAPTALDH1A1
SCHEMBL9706141 0.86 KDM4E (0.73) KDM4ETSHRESR1KMT2AMAPT
SCHEMBL9810819 0.85 ALDH1A1 (0.50) KDM4ETSHRKMT2AMAPTALDH1A1
SCHEMBL4224021 0.84 ALDH1A1 (0.46) KDM4ETSHRESR1KMT2AMAPT
SCHEMBL11243339 0.83 TSHR (0.50) KDM4ETSHRKMT2AMAPTCYP1A2
SCHEMBL10806850 0.83 ALDH1A1 (0.45) KDM4ETSHRESR1KMT2AMAPT
SCHEMBL21835134 0.82 ALDH1A1 (0.47) KDM4ETSHRKMT2AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0214852-B1 PERFLUOROAMINOETHERS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1992-10-28 — — EP disclosed
US-5049670-A Pour point MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-09-17 — — US disclosed
US-4929725-A NONFLAMMABLE, HYDRAULIC FLUIDS MOORE GEORGE G I (US) 1990-05-29 — — US disclosed
US-4788339-A HIGH BOILING, LOW POUR POINT; HYDRAULIC FLUIDS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-11-29 — — US disclosed
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