SCHEMBL11741978

SCHEMBL11741978

CCCCCCCCCCCCCCCCCN1CCN(C)CC1.CCCCCCCCCCCCCCCCN1CCN(C)CC1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 6/20 0.65
GNAO1 P09471 6/20 0.65
GNAI1 P63096 6/20 0.65
PAOX Q6QHF9 1/20 0.55
KDM4E B2RXH2 2/20 0.50
GAA P10253 1/20 0.50
LMNA P02545 1/20 0.49
ALDH1A1 P00352 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
SIGMAR1 Q99720 2/20 0.47
GUSB P08236 2/20 0.47
EBP Q15125 1/20 0.47
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL11740596 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL10725884 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL4911879 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL4304828 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL10520655 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL5770286 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL11737892 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL11739399 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL11739779 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E
SCHEMBL11740614 1.00 GNAI3 (0.65) GNAI3GNAO1GNAI1PAOXKDM4E

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-4057413-A Methods and compositions for regulating plant growth using piperazine compounds BAYER AKTIENGESELLSCHAFT (DT) 1977-11-08 US disclosed