SCHEMBL8147105

SCHEMBL8147105

CC1CCC(C(C)C)C(OP(=O)(O)OCCN)C1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
LMNA P02545 4/20 0.50
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 2/20 0.41
EPHX1 P07099 3/20 0.40
HPGD P15428 1/20 0.39
GAA P10253 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP19A1 P11511 2/20 0.39
NFE2L2 Q16236 1/20 0.38
TRPA1 O75762 2/20 0.37
TRPM8 Q7Z2W7 2/20 0.37
APOBEC3A P31941 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
P2RX4 Q99571 1/20 0.36

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
SCHEMBL7112455 0.92 ALDH1A1 (0.48) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL7113763 0.92 ALDH1A1 (0.48) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL8148495 0.85 ALDH1A1 (0.45) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL8145483 0.85 ALDH1A1 (0.61) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL9484139 0.84 ALDH1A1 (0.57) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL9484811 0.84 ALDH1A1 (0.44) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL9485019 0.84 ALDH1A1 (0.44) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL9483991 0.84 ALDH1A1 (0.44) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL8988919 0.82 ALDH1A1 (0.55) ALDH1A1LMNAMEN1KMT2AKDM4E
SCHEMBL8988670 0.79 ALDH1A1 (0.52) ALDH1A1LMNAMEN1KMT2AKDM4E

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
WO-2000013690-A1 EXOCYCLIC-PHOSPHOETHANOLAMINES CLARION PHARMACEUTICALS, INC. (US) 2000-03-16 WO disclosed
US-5804569-A ANTIINFLAMMATORY, ANTIARRHYMIC AND LOCAL ANESTHETIC AGENT CLARION PHARMACEUTICALS INC. (US) 1998-09-08 US disclosed