SCHEMBL8995217

SCHEMBL8995217

CCCCNCc1[c]cccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
CYP1A2 P05177 3/20 0.38
CYP2D6 P10635 3/20 0.38
CYP2C19 P33261 3/20 0.38
MAOA P21397 1/20 0.37
LMNA P02545 1/20 0.37
CHRM2 P08172 1/20 0.36
HTR1A P08908 1/20 0.36
HTR1D P28221 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR7 P34969 1/20 0.36
HTR2B P41595 1/20 0.36
HTR5A P47898 1/20 0.36
HTR6 P50406 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
SCHEMBL8995479 0.95 HRH4 (0.47) HRH4HRH3SIGMAR1SMN1; SMN2CYP1A2
SCHEMBL7716154 0.93 HRH4 (0.46) HRH4HRH3SIGMAR1SMN1; SMN2CYP1A2
SCHEMBL7715270 0.89 MAOA (0.36) HRH4HRH3SIGMAR1MAOACHRM2
SCHEMBL16892600 0.84 SIGMAR1 (0.46) SIGMAR1TSHRHTT
SCHEMBL16935742 0.82 MC4R (0.46) CYP1A2CYP2C19MAOACHRM2TSHR
SCHEMBL9654441 0.81 MC4R (0.43) SIGMAR1KDM4EMAOALMNACHRM2
SCHEMBL2090459 0.81 GAA (0.34) GAACYP2D6HTR1AHTR1DHTR2A
SCHEMBL16892533 0.78 SIGMAR1 (0.51) HRH4HRH3SIGMAR1CYP1A2CYP2D6
SCHEMBL17929 0.75 LTA4H (0.35) SIGMAR1CYP2D6
SCHEMBL28079021 0.73 LTA4H (0.34) SIGMAR1CYP2D6

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
EP-3390491-A1 METHOD FOR ISOLATING A PHENYLENE ETHER OLIGOMER COMPOSITION AND PHENYLENE ETHER OLIGOMER COMPOSITION SABIC Global Technologies B.V. (NL) 2018-10-24 EP disclosed
WO-2017105705-A1 METHOD FOR ISOLATING A PHENYLENE ETHER OLIGOMER COMPOSITION AND PHENYLENE ETHER OLIGOMER COMPOSITION SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2017-06-22 WO disclosed
US-5496844-A Indole derivatives OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1996-03-05 US disclosed
EP-0639567-A1 INDOLE DERIVATIVE OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1995-02-22 EP disclosed