SCHEMBL29026700

SCHEMBL29026700

CC(c1c(Cl)cc(Cl)cc1Cl)n1cccn1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.39
KCNH2 Q12809 1/20 0.39
NOTUM Q6P988 2/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
MET P08581 1/20 0.32
ALDH1A1 P00352 1/20 0.31
F2 P00734 1/20 0.31
PLAU P00749 1/20 0.31
KLKB1 P03952 1/20 0.31
ELANE P08246 1/20 0.31
ACLY P53396 1/20 0.30
MAPK1 P28482 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
SCHEMBL24961335 0.86 HRH1 (0.42) HRH1KCNH2NOTUMGAAMAPT
SCHEMBL29751644 0.71 JAK2 (0.38) LMNA
SCHEMBL29191559 0.68 MEN1 (0.31) HRH1KCNH2MEN1KMT2A
SCHEMBL22369257 0.68 CYP2D6 (0.45) HRH1KCNH2MEN1LMNAKMT2A
SCHEMBL15174490 0.68 CYP2D6 (0.45) HRH1KCNH2MEN1LMNAKMT2A
SCHEMBL29191541 0.68 GAA (0.36) HRH1KCNH2NOTUMGAAMAPT
SCHEMBL11152177 0.68
SCHEMBL16401424 0.67 GAA (0.44) GAA
SCHEMBL174399 0.67
SCHEMBL11486690 0.67 ADRA2C (0.46) KCNH2NOTUMGAAMAPTMEN1

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
CN-109789146-B Chemokine receptor modulators and uses thereof 拉普特医疗公司 2023-04-18 CN disclosed