SCHEMBL7780096

SCHEMBL7780096

CCOC(=O)C(Cc1ccccn1)(C(=O)O)c1ccccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
POLB P06746 1/20 0.41
GPR119 Q8TDV5 2/20 0.39
KMT2A Q03164 2/20 0.38
HPGD P15428 2/20 0.38
RAB9A P51151 3/20 0.37
FDPS P14324 1/20 0.36
PIN1 Q13526 1/20 0.36
LMNA P02545 2/20 0.36
NPC1 O15118 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
OPRD1 P41143 1/20 0.36

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
SCHEMBL5861610 0.94 POLB (0.43) ALDH1A1KDM4EPOLBGPR119KMT2A
SCHEMBL7787285 0.81 TRPM8 (0.45) ALDH1A1KDM4EPOLBRAB9AFDPS
SCHEMBL7780059 0.79 RAB9A (0.43) ALDH1A1KDM4EKMT2ARAB9AFDPS
SCHEMBL7788753 0.78 ALDH1A1 (0.40) ALDH1A1KDM4EPOLBRAB9AFDPS
SCHEMBL5861519 0.77 TRPM8 (0.47) ALDH1A1KDM4EKMT2ARAB9AFDPS
SCHEMBL5860443 0.76 L3MBTL1 (0.41) ALDH1A1KDM4EKMT2AHPGDRAB9A
SCHEMBL5140898 0.76 CYP1A2 (0.48) ALDH1A1KDM4EKMT2ARAB9AFDPS
SCHEMBL5862781 0.76 ALDH1A1 (0.47) ALDH1A1KDM4EKMT2ARAB9AFDPS
SCHEMBL5861527 0.75 RAB9A (0.46) ALDH1A1KDM4EPOLBKMT2ARAB9A
SCHEMBL5861419 0.74 MAPT (0.40) ALDH1A1KDM4EPOLBKMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140784-A2 ION CHANNEL MODULATING AGENTS NEUROSEARCH A/S (DK) 2001-10-10 EP claimed
WO-2000037422-A2 ION CHANNEL MODULATING AGENTS NEUROSEARCH A/S (DK) 2000-06-29 WO claimed