SCHEMBL20070959

SCHEMBL20070959

CN1CCN(C(=O)C(c2cccc(Cl)c2)N(C)C)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
TSHR P16473 2/20 0.47
MAPK1 P28482 1/20 0.47
RECQL P46063 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CHRM1 P11229 3/20 0.45
RET P07949 3/20 0.44
CHRM3 P20309 2/20 0.44
KMT2A Q03164 1/20 0.44
TP53 P04637 1/20 0.44
ALOX15 P16050 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SLC6A2 P23975 3/20 0.43
SLC6A3 Q01959 3/20 0.43

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
SCHEMBL22030558 0.88 LMNA (0.46) LMNATSHRMAPK1RECQLNPSR1
SCHEMBL20148580 0.87 CHRM1 (0.47) LMNATSHRMAPK1RECQLNPSR1
SCHEMBL23126238 0.86 LMNA (0.45) LMNATSHRMAPK1RECQLNPSR1
SCHEMBL18713211 0.83 CHRM1 (0.58) TSHRKDM4ECHRM1CHRM3NPC1
SCHEMBL18390255 0.82 ROCK2 (0.55) LMNATSHRMAPK1RECQLNPSR1
SCHEMBL20412808 0.82 RET (0.46) LMNATSHRALDH1A1KDM4EMAPT
SCHEMBL20070962 0.81 ROCK2 (0.56) LMNATSHRMAPK1RECQLNPSR1
SCHEMBL890215 0.75 ALDH1A1 (0.47) ALDH1A1MAPTHTTKMT2ASLC6A2
SCHEMBL755746 0.75 ALDH1A1 (0.50) ALDH1A1KMT2ASLC6A2SLC6A4
SCHEMBL18390270 0.75 SMN1; SMN2 (0.46) LMNAALDH1A1HTTSMN1; SMN2CHRM1

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-2018071447-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ANDREWS STEVEN W (US) 2018-04-19 WO disclosed