SCHEMBL17345005

SCHEMBL17345005

CCCCCCCCCCCC[N+](C)(CCC)CCC

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 10/20 0.62
HTT P42858 1/20 0.60
SLC22A1 O15245 1/20 0.58
ALDH1A1 P00352 1/20 0.55
TP53 P04637 1/20 0.55
CYP3A4 P08684 1/20 0.55
ALOX15 P16050 1/20 0.55
TSHR P16473 1/20 0.55
ALOX12 P18054 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HIF1A Q16665 1/20 0.55
HSD17B10 Q99714 1/20 0.55
LSS P48449 1/20 0.55

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
SCHEMBL3311711 1.00 DNM1 (0.62) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL26306438 1.00 DNM1 (0.62) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL2334047 1.00 DNM1 (0.62) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL11862557 1.00 DNM1 (0.62) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL26306423 1.00 DNM1 (0.62) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL3304006 1.00 DNM1 (0.62) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL3309633 1.00 DNM1 (0.62) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL26306429 1.00 DNM1 (0.62) DNM1HTTSLC22A1ALDH1A1TP53
Fluoride Ion SCHEMBL11748121 0.97 DNM1 (0.59) DNM1HTTSLC22A1ALDH1A1TP53
Hydrochloric Acid SCHEMBL11403208 0.97 DNM1 (0.62) DNM1HTTSLC22A1ALDH1A1TP53

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-20150361323-A1 TREATMENT FLUIDS FOR REDUCING SUBTERRANEAN FORMATION DAMAGE HALLIBURTON ENERGY SERVICES, INC. (US) 2015-12-17 US disclosed