SCHEMBL11219009

SCHEMBL11219009

O=C(Nc1ccc(Cl)c(Cl)c1O)OCCCl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 3/20 0.47
CXCR1 P25024 1/20 0.47
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 2/20 0.37
LMNA P02545 2/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
TSHR P16473 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CX3CR1 P49238 1/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
CHRM3 P20309 1/20 0.36
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL11218914 0.76 LMNA (0.41) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL11218647 0.74 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL19932178 0.74 CXCR2 (0.48) CXCR2CXCR1MEN1KMT2ALMNA
SCHEMBL19927416 0.73 CXCR2 (0.57) CXCR2CXCR1MEN1KMT2AMAPT
SCHEMBL9024697 0.71 L3MBTL1 (0.42) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL9463834 0.70 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2KMT2AMAPTLMNA
SCHEMBL11081946 0.69 SMN1; SMN2 (0.40) ALDH1A1SMN1; SMN2KMT2AMAPTLMNA
SCHEMBL8410380 0.68 CXCR2 (0.55) CXCR2CXCR1ALDH1A1MEN1KMT2A
SCHEMBL9760575 0.68 KCNMA1 (0.51) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7135205 0.68 EPHX2 (0.36) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0023257-B1 Dichloro-hydroxyethylamino phenols, process for their production, their use and hair dyeing compositions containing them Henkel Kommanditgesellschaft auf Aktien (DE) 1982-06-30 EP claimed
EP-0023257-A1 Dichloro-hydroxyethylamino phenols, process for their production, their use and hair dyeing compositions containing them Henkel Kommanditgesellschaft auf Aktien (DE) 1981-02-04 EP claimed
EP-0023257-B1 Dichloro-hydroxyethylamino phenols, process for their production, their use and hair dyeing compositions containing them Henkel Kommanditgesellschaft auf Aktien (DE) 1982-06-30 EP disclosed
EP-0023257-A1 Dichloro-hydroxyethylamino phenols, process for their production, their use and hair dyeing compositions containing them Henkel Kommanditgesellschaft auf Aktien (DE) 1981-02-04 EP disclosed