SCHEMBL8679488

SCHEMBL8679488

Cl[Hf](Cl)c1c(C2=CC=CC2)ccc2c1Cc1ccccc1-2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.36
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
PGR P06401 1/20 0.34
CYP1A2 P05177 3/20 0.32
HTR2B P41595 2/20 0.32
ADRA2A P08913 1/20 0.32
MAOA P21397 1/20 0.32
SLC6A2 P23975 1/20 0.32
HTR2C P28335 1/20 0.32
SLC6A4 P31645 1/20 0.32
SRD5A2 P31213 1/20 0.32
MAPT P10636 3/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 2/20 0.31
HSD17B10 Q99714 2/20 0.30

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
SCHEMBL9278264 0.83 PNMT (0.34) PNMTNPC1RAB9APGRCYP1A2
SCHEMBL27348144 0.82 PNMT (0.45) PNMTNPC1RAB9APGRHTR2B
SCHEMBL28220071 0.80 PNMT (0.44) PNMTNPC1RAB9APGRHTR2B
SCHEMBL28286932 0.80 PNMT (0.44) PNMTNPC1RAB9APGRHTR2B
SCHEMBL6437444 0.79 PNMT (0.37) PNMTNPC1RAB9APGRCYP1A2
SCHEMBL7625230 0.79 PNMT (0.37) PNMTNPC1RAB9APGRCYP1A2
SCHEMBL9659755 0.79 PNMT (0.37) PNMTNPC1RAB9APGRCYP1A2
SCHEMBL28762096 0.79 PNMT (0.37) PNMTNPC1RAB9APGRCYP1A2
SCHEMBL9186251 0.79 PNMT (0.31) PNMTNPC1RAB9APGRCYP1A2
Hydrochloric Acid SCHEMBL27425148 0.79 PNMT (0.42) PNMTNPC1RAB9APGRHTR2B

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-5756614-A PRODUCES A CHAIN OF ALTERNATING STEREO-REGULAR CRYSTALLIZABLE SEGMENTS AND STEREO-IRREGULAR NONCRYSTALLIZABLE SEGMENTS, THE FORMER ACTING AS PHYSICAL CROSSLINKS; ENABLES ELASTIC RECOVERY OF STRETCHED SPECIMENS ACADEMY OF APPLIED SCIENCE (US) 1998-05-26 US disclosed