SCHEMBL5403299

SCHEMBL5403299

Cc1[nH]nc(C(=O)Cl)c1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.43
CHUK O15111 1/20 0.33
ALOX15 P16050 1/20 0.33
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
P2RX7 Q99572 1/20 0.31
PDE4D Q08499 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
SCHEMBL15825699 0.87 HCAR2 (0.58) HCAR2
SCHEMBL31162505 0.74 HCAR2 (0.50) HCAR2KDM4EPDE4D
SCHEMBL9956866 0.71 HCAR2 (0.47) HCAR2P2RX7PDE4D
SCHEMBL6257457 0.70 KDM4E (0.44) HCAR2CHUKKDM4EPOLBMAPT
SCHEMBL21711399 0.69 DYRK1A (0.46) HCAR2KDM4EP2RX7PDE4D
SCHEMBL4185273 0.67 ALOX15 (0.44) HCAR2ALOX15KMT2A
SCHEMBL16586297 0.67 HCAR2 (0.42) HCAR2ALOX15
SCHEMBL10864602 0.64 HCAR2 (0.44) HCAR2ALOX15
SCHEMBL15592682 0.64 HCAR2 (0.40) HCAR2KDM4EPDE4D
SCHEMBL8507200 0.63 KDM4E (0.38) HCAR2KDM4EPOLBMAPTKMT2A

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
WO-2007084868-A2 TREATMENT OF DISORDERS BY ACTIVATION OF THE UNFOLDED PROTEIN RESPONSE KALYPSYS, INC. (US) 2007-07-26 WO disclosed