SCHEMBL6557162

SCHEMBL6557162

CCCCN1CNCNC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GLB1 P16278 1/20 0.40
GNAO1 P09471 8/20 0.36
GNAI3 P08754 7/20 0.36
GNAI1 P63096 7/20 0.36
GBA1 P04062 2/20 0.35
GUSB P08236 2/20 0.33
EBP Q15125 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL20418301 0.93 GNAO1 (0.43) GLB1GNAO1GNAI3GNAI1GBA1
SCHEMBL8751413 0.91 GNAO1 (0.46) GNAO1GNAI3GNAI1GBA1GUSB
SCHEMBL3313743 0.91 GNAO1 (0.46) GNAO1GNAI3GNAI1GBA1GUSB
SCHEMBL3310643 0.91 GNAO1 (0.46) GNAO1GNAI3GNAI1GBA1GUSB
Hydrochloric Acid SCHEMBL27558043 0.87 GNAO1 (0.43) GNAO1GNAI3GNAI1GBA1GUSB
SCHEMBL11681717 0.84
SCHEMBL27558042 0.83 GNAO1 (0.41) GNAO1GNAI3GNAI1GUSBEBP
Propene SCHEMBL28313374 0.83 GNAO1 (0.38) GNAO1GNAI3GNAI1GUSBEBP
SCHEMBL8582471 0.83 TSHR (0.39) GNAO1GNAI3GNAI1GBA1SIGMAR1
Dimethylamine SCHEMBL5508399 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115569624-B Continuous production equipment and production method of nitrogen-doped organic sulfur removal agent 广汉市福客科技有限公司 2023-12-19 CN disclosed
CN-115569624-A Continuous production equipment and production method of nitrogen-containing organic desulfurizing agent 广汉市福客科技有限公司 2023-01-06 CN disclosed
EP-1487764-A1 OLIGOMERIZATION OF OLEFINS COMPRISING AT LEAST THREE CARBON ATOMS BASF AKTIENGESELLSCHAFT (DE) 2004-12-22 EP disclosed
WO-2003076368-A1 OLIGOMERIZATION OF OLEFINS COMPRISING AT LEAST THREE CARBON ATOMS BASF AKTIENGESELLSCHAFT (DE) 2003-09-18 WO disclosed