SCHEMBL8699201

SCHEMBL8699201

CN(CCO[N+](C)(C)Cc1cccc(Cl)c1)Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TMEM97 Q5BJF2 2/20 0.46
SIGMAR1 Q99720 2/20 0.46
PYCR1 P32322 1/20 0.45
ATM Q13315 1/20 0.44
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
TSHR P16473 2/20 0.44
TAAR1 Q96RJ0 1/20 0.43
CARM1 Q86X55 2/20 0.43
PRMT1 Q99873 1/20 0.43
ACHE P22303 4/20 0.42
PRMT6 Q96LA8 1/20 0.42
PRMT8 Q9NR22 1/20 0.42

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 SCHEMBL8704288 0.99 SMN1; SMN2 (0.47) GAASMN1; SMN2TMEM97SIGMAR1PYCR1
SCHEMBL8700961 0.94 SIGMAR1 (0.48) GAASMN1; SMN2TMEM97SIGMAR1PYCR1
Hydrochloric Acid SCHEMBL8705540 0.93 SIGMAR1 (0.47) GAASMN1; SMN2TMEM97SIGMAR1ATM
SCHEMBL8699753 0.86 TMEM97 (0.51) GAASMN1; SMN2TMEM97SIGMAR1ATM
SCHEMBL8702923 0.86 TSHR (0.53) SMN1; SMN2SIGMAR1ATMHTR1DHTR1B
SCHEMBL8704864 0.86 ATM (0.55) GAASMN1; SMN2TMEM97SIGMAR1PYCR1
Hydrochloric Acid SCHEMBL8699226 0.85 TMEM97 (0.50) GAASMN1; SMN2TMEM97SIGMAR1ATM
Hydrochloric Acid SCHEMBL8704833 0.84 SMN1; SMN2 (0.52) SMN1; SMN2SIGMAR1ATMHTR1DHTR1B
SCHEMBL8699293 0.84 HTR1D (0.44) SMN1; SMN2HTR1DHTR1BTSHRTAAR1
Hydrochloric Acid SCHEMBL8704210 0.84 ATM (0.53) GAASMN1; SMN2TMEM97SIGMAR1PYCR1

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-5736568-A ANTIALLERGENS; IMMUNOMODULANTS KNOLL AKTIENGESELLSCHAFT (DE) 1998-04-07 US disclosed