SCHEMBL9725487

SCHEMBL9725487

O=c1[nH]c2ccc(Cl)cc2n1CCN1CCCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 6/20 0.55
LMNA P02545 2/20 0.53
GRIN1 Q05586 2/20 0.51
GRIN2B Q13224 2/20 0.51
DAO P14920 1/20 0.50
HTR7 P34969 4/20 0.49
HTR1A P08908 2/20 0.48
MEN1 O00255 1/20 0.48
SLC22A2 O15244 1/20 0.48
NR1I2 O75469 1/20 0.48
GMNN O75496 1/20 0.48
USP2 O75604 1/20 0.48
CYP1A2 P05177 1/20 0.48
GLA P06280 1/20 0.48
ADRB2 P07550 1/20 0.48
ADRB1 P08588 1/20 0.48
CYP3A4 P08684 1/20 0.48
ADRA2A P08913 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
CYP2D6 P10635 1/20 0.48

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
Hydrochloric Acid SCHEMBL9725400 0.99 LMNA (0.55) TMEM97LMNAGRIN1GRIN2BDAO
SCHEMBL9725368 0.99 TMEM97 (0.57) TMEM97LMNAGRIN1GRIN2BDAO
Hydrochloric Acid SCHEMBL9725484 0.97 LMNA (0.57) TMEM97LMNAGRIN1GRIN2BDAO
SCHEMBL738090 0.89 HTR7 (0.50) TMEM97LMNAGRIN1GRIN2BDAO
Hydrochloric Acid SCHEMBL9725415 0.88 HTR7 (0.49) TMEM97LMNADAOHTR7HTR1A
SCHEMBL11199049 0.81 P2RX7 (0.76) LMNAHTR7HTR1AMEN1SLC22A2
SCHEMBL11708301 0.81 DAO (0.57) LMNADAOHTR7HTR1AMEN1
SCHEMBL4042957 0.80 LMNA (0.79) LMNAHTR7HTR1AMEN1NR1I2
SCHEMBL11703773 0.80 DAO (0.59) LMNADAOHTR7MEN1CYP1A2
SCHEMBL318631 0.80 DAO (0.55) LMNADAOHTR7HTR1AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0454330-A1 Benzimidazolinone derivatives YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1991-10-30 EP claimed
US-5162318-A Which have pulmonary surfactant secretion promoting activity YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1992-11-10 US disclosed
EP-0454330-A1 Benzimidazolinone derivatives YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1991-10-30 EP disclosed