SCHEMBL6142247

SCHEMBL6142247

CN(Cc1ccc(Cl)cc1)Cc1ccc(OCl)nc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 1/20 0.45
TSHR P16473 2/20 0.43
KDM4E B2RXH2 2/20 0.43
LSS P48449 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
CCR5 P51681 1/20 0.40
P2RX7 Q99572 1/20 0.39
PSEN1 P49768 2/20 0.38
PSEN2 P49810 2/20 0.38
APH1B Q8WW43 2/20 0.38
NCSTN Q92542 2/20 0.38
APH1A Q96BI3 2/20 0.38
PSENEN Q9NZ42 2/20 0.38
LMNA P02545 1/20 0.38
CXCR3 P49682 1/20 0.37
TMEM97 Q5BJF2 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL6141789 0.79 BACE1 (0.44) TSHRKDM4EALDH1A1LMNACYP1A2
SCHEMBL18532755 0.77 PYCR1 (0.67) PYCR1TSHRKDM4ELSSALDH1A1
SCHEMBL5697695 0.76 HRH3 (0.46)
SCHEMBL6142120 0.74 CRHBP (0.47) KDM4EALDH1A1
SCHEMBL29607692 0.72 ALDH1A1 (0.47) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL28473856 0.72 ALDH1A1 (0.47) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL6141682 0.72 HRH3 (0.56) KDM4EALDH1A1PSEN1PSEN2APH1B
SCHEMBL3149087 0.69 PYCR1 (0.56) PYCR1TSHRKDM4ELSSALDH1A1
SCHEMBL9513831 0.68 PYCR1 (0.60) PYCR1TSHRKDM4ELSSALDH1A1
SCHEMBL10663042 0.66 PYCR1 (0.58) PYCR1TSHRKDM4ELSSALDH1A1

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-1492785-A1 NEW COMPOUNDS AstraZeneca AB (SE) 2005-01-05 EP claimed
WO-2003082853-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 2003-10-09 WO claimed
EP-1492785-A1 NEW COMPOUNDS AstraZeneca AB (SE) 2005-01-05 EP disclosed
WO-2003082853-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 2003-10-09 WO disclosed