SCHEMBL27967792

SCHEMBL27967792

Clc1cc(Cl)cc(-c2c[nH]c(Cc3cc(Cl)ccc3Cl)n2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ DBH P09172 1/20 0.34
▸ GPR84 Q9NQS5 2/20 0.33
▸ PDGFRB P09619 2/20 0.33
▸ KIT P10721 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ CCR2 P41597 1/20 0.32
▸ MEN1 O00255 3/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ POLB P06746 1/20 0.32
▸ DHODH Q02127 2/20 0.32
▸ LMNA P02545 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ HIF1A Q16665 2/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ SLC22A1 O15245 1/20 0.31

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
SCHEMBL2864049 0.90 ROCK2 (0.38) ROCK2PIM1GSK3BDBHGPR84
SCHEMBL26110323 0.89 PIK3CA (0.39) ROCK2PIM1GSK3BDBHMEN1
SCHEMBL27967986 0.89 SMN1; SMN2 (0.42) MEN1KMT2ALMNAMAPTCYP2C9
SCHEMBL2868946 0.87 MEN1 (0.44) MEN1KMT2APOLBMAPTHIF1A
SCHEMBL2873524 0.86 MAPT (0.41) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL27967785 0.84 MEN1 (0.36) ROCK2PIM1GSK3BDBHGPR84
SCHEMBL27967894 0.84 IDO1 (0.42) ROCK2PIM1GSK3BDBHGPR84
SCHEMBL26110448 0.84 CYP2A6 (0.40) ROCK2PIM1GSK3BPDGFRBKDR
SCHEMBL26113674 0.83 HSP90AA1 (0.40) DBHMEN1KMT2ALMNAMAPT
SCHEMBL14334850 0.83 SLC5A2 (0.38) ROCK2PIM1GSK3BPDGFRBKMT2A

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-102119240-B Surface treating agent for copper or copper alloy and use thereof SHIKOKU CHEM 2014-07-30 — — CN disclosed
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