SCHEMBL7585205

SCHEMBL7585205

CCCCCCCCCCCC1N(C)CCN1CCO

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 3/20 0.38
S1PR3 Q99500 3/20 0.38
S1PR5 Q9H228 3/20 0.38
GBA1 P04062 7/20 0.36
S1PR4 O95977 1/20 0.36
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.35
GBA2 Q9HCG7 8/20 0.34
GAA P10253 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
SCHEMBL9214147 0.84 S1PR1 (0.38) S1PR1S1PR3S1PR5GBA1S1PR4
SCHEMBL141304 0.82 FAAH (0.38) LMNAHSD17B10KMT2A
SCHEMBL4626362 0.81 CYP2D6 (0.39) S1PR3LMNAALDH1A1KMT2ATSHR
SCHEMBL2267104 0.81 ALDH1A1 (0.43) S1PR1S1PR3S1PR5S1PR4ALDH1A1
SCHEMBL1831029 0.81 ALDH1A1 (0.43) S1PR1S1PR3S1PR5S1PR4ALDH1A1
SCHEMBL1832672 0.81 ALDH1A1 (0.43) S1PR1S1PR3S1PR5S1PR4ALDH1A1
SCHEMBL1836046 0.81 ALDH1A1 (0.43) S1PR1S1PR3S1PR5S1PR4ALDH1A1
Hydrochloric Acid SCHEMBL142026 0.81 FAAH (0.37) LMNAHSD17B10KMT2A
Hydrochloric Acid SCHEMBL142028 0.81 FAAH (0.37) LMNAHSD17B10KMT2A
SCHEMBL22221811 0.80 S1PR1 (0.38) S1PR1S1PR3S1PR5GBA1S1PR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242670-A1 WATER- AND OIL-REPELLENT, ANTISTATIC COMPOSITION 3M Innovative Properties Company (US) 2002-09-25 EP disclosed
WO-2001049925-A1 WATER- AND OIL-REPELLENT, ANTISTATIC COMPOSITION 3M INNOVATIVE PROPERTIES COMPANY (US) 2001-07-12 WO disclosed