SCHEMBL21484730

SCHEMBL21484730

O=C(CCl)NCCNc1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 1/20 0.56
YAP1 P46937 1/20 0.56
TEAD4 Q15561 1/20 0.56
TEAD2 Q15562 1/20 0.56
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
ALDH1A1 P00352 4/20 0.52
GAA P10253 2/20 0.52
MAPT P10636 2/20 0.52
CNR1 P21554 4/20 0.47
RHOC P08134 1/20 0.44
RHOA P61586 1/20 0.44
LMNA P02545 2/20 0.43
GSK3B P49841 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
JAK2 O60674 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HDAC1 Q13547 1/20 0.41
FFAR1 O14842 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
SCHEMBL11437199 0.83 EPHX1 (0.50) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL9639726 0.79 MAPT (0.55) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL20725799 0.78 ALDH1A1 (0.58) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL1503954 0.76 NPC1 (0.66) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL16922181 0.76 NPC1 (0.66) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL8006944 0.76 MEN1 (0.72) MEN1KMT2AALDH1A1GAASMN1; SMN2
SCHEMBL5574769 0.76 LMNA (0.66) TEAD1YAP1TEAD4TEAD2MEN1
SCHEMBL14620842 0.74 GRIN1 (0.47) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL1947326 0.73 MEN1 (0.47) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL2296216 0.73 FFAR1 (0.60) MEN1KMT2AALDH1A1GAAMAPT

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-3552664-A1 PROTEOSTASIS REGULATORS Proteostasis Therapeutics, Inc. (US) 2019-10-16 EP disclosed