SCHEMBL8616157

SCHEMBL8616157

CCC1(c2c[nH]cn2)Cc2cc(F)c(Cl)cc2C1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.36
ADRA2B P18089 2/20 0.36
ADRA2C P18825 2/20 0.36
ADRA1B P35368 2/20 0.36
MAPT P10636 1/20 0.31
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 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
SCHEMBL4626063 0.90 ADRA2A (0.40) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL7640608 0.90 ADRA2A (0.35) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL8611497 0.84 ADRA2A (0.36) ADRA2AADRA2BADRA2CADRA1B
Fipamezole SCHEMBL935549 0.80 ADRA2A (0.57) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL8615811 0.79 PGK1 (0.38)
Fipamezole SCHEMBL3901401 0.79 ADRA2A (0.56) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL8610304 0.75 ADRA2A (0.40) ADRA2AADRA2BADRA2CADRA1B
Atipamezole SCHEMBL31147780 0.75 ADRA2A (0.50) ADRA2AADRA2BADRA2CADRA1B
SCHEMBL18826058 0.74 ADRA2A (0.67) ADRA2AADRA2BADRA2CADRA1BMAPT
Fipamezole SCHEMBL9354688 0.72 ADRA2A (0.52) ADRA2AADRA2BADRA2CADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618906-B1 SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR PREPARATION AND USE JUVANTIA PHARMA LTD OY (FI) 1998-04-22 EP disclosed
US-5498623-A MULTISTAGE REACTION FOR HALOGENATION OF COMPOUNDS, NITRATION, REDUCTION AND CONVERSION TO DIAZONIUM SALT THEN HALOGENATION FOR COGNITIVE DISORDERS ORION-YHTYMA OY (FI) 1996-03-12 US disclosed