SCHEMBL7186269

SCHEMBL7186269

C=CC(c1cnc[nH]c1=O)N1CCC(c2c[nH]c3ccccc23)CC1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
BRD4 O60885 1/20 0.45
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
CREBBP Q92793 1/20 0.45
ATM Q13315 1/20 0.45
CCR2 P41597 2/20 0.43
ADRA1D P25100 4/20 0.41
HTR2C P28335 2/20 0.41
ADRB2 P07550 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL3380819 0.83 KDM4E (0.54) KDM4EBRD4ALDH1A1POLBCREBBP
SCHEMBL7186275 0.73 KDM4E (0.46) KDM4EBRD4ALDH1A1POLBCREBBP
SCHEMBL25758177 0.70 KDM4E (0.63) KDM4EBRD4ALDH1A1POLBCREBBP
SCHEMBL13801324 0.68 KDM4E (0.64) KDM4EBRD4ALDH1A1POLBCREBBP
SCHEMBL3256692 0.68 KDM4E (0.83) KDM4EBRD4ALDH1A1POLBCREBBP
SCHEMBL30415306 0.68 KDM4E (0.83) KDM4EBRD4ALDH1A1POLBCREBBP
Hydrochloric Acid SCHEMBL27732898 0.67 KDM4E (0.81) KDM4EBRD4ALDH1A1POLBCREBBP
SCHEMBL11577771 0.66 LMNA (0.44) KDM4EALDH1A1POLBADRA1DHTR2C
SCHEMBL11039324 0.66 KDM4E (0.58) KDM4EBRD4ALDH1A1POLBCREBBP
SCHEMBL30909145 0.66 KDM4E (0.58) KDM4EBRD4ALDH1A1POLBCREBBP

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
EP-0808313-B1 ANTIPSYCHOTIC 4-(1H-INDOLYL-1-YL)-1-SUBSTITUTED PIPERIDINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2003-08-13 EP disclosed