SCHEMBL14519151

SCHEMBL14519151

CC(C)C1CCCN(CCO)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
PKM P14618 1/20 0.39
SLC18A3 Q16572 1/20 0.39
KDM1A O60341 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 2/20 0.36
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
OPRL1 P41146 1/20 0.34
HTR4 Q13639 1/20 0.34
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 1/20 0.34
RAD52 P43351 1/20 0.34
HTT P42858 1/20 0.33

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
SCHEMBL2603219 0.92 SLC18A3 (0.43) KMT2APKMSLC18A3KDM1ALMNA
SCHEMBL14519148 0.85 ALDH1A1 (0.39) KMT2APKMSMN1; SMN2LMNAOPRM1
SCHEMBL14652141 0.85 ALDH1A1 (0.39) KMT2APKMSMN1; SMN2LMNAOPRM1
SCHEMBL14519150 0.85 DRD2 (0.41) SMN1; SMN2
SCHEMBL2116406 0.81 GNAI3 (0.39) SLC18A3
SCHEMBL10442555 0.81 SLC18A3 (0.37) KMT2APKMSLC18A3LMNAOPRM1
SCHEMBL12384497 0.81 SLC18A3 (0.37) KMT2APKMSLC18A3LMNAOPRM1
SCHEMBL6026443 0.80 SLC18A3 (0.43) KMT2APKMSLC18A3KDM1ALMNA
SCHEMBL13010704 0.80 KDM4E (0.40) KMT2ASMN1; SMN2OPRM1OPRL1KDM4E
SCHEMBL19602200 0.80 GNAO1 (0.51)

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-7199147-B2 Rho kinase inhibitors DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-03 US disclosed