SCHEMBL22796402

SCHEMBL22796402

O=C(c1ccc(Cl)cc1)N1CCN(c2nc3ccccc3n3cccc23)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.60
LMNA P02545 4/20 0.60
MAPT P10636 2/20 0.60
THRB P10828 1/20 0.60
HTR3E A5X5Y0 5/20 0.57
HTR3B O95264 5/20 0.57
HTR3A P46098 5/20 0.57
HTR3D Q70Z44 5/20 0.57
HTR3C Q8WXA8 5/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
USP2 O75604 1/20 0.56
CASP1 P29466 1/20 0.56
CASP7 P55210 1/20 0.56
HTR2C P28335 4/20 0.55
HTR1A P08908 3/20 0.55
HSD17B10 Q99714 1/20 0.51
ALDH1A1 P00352 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
RAB9A P51151 1/20 0.49

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
SCHEMBL22796404 0.86 HTR3E (0.56) TP53LMNAMAPTHTR3EHTR3B
SCHEMBL8565555 0.82 HTR3E (0.67) TP53LMNAMAPTTHRBHTR3E
SCHEMBL8563501 0.76 LMNA (0.56) TP53LMNAMAPTTHRBHTR3E
SCHEMBL8567429 0.76 HTR3E (0.75) TP53LMNAMAPTHTR3EHTR3B
SCHEMBL8565448 0.75 LMNA (0.59) TP53LMNAMAPTTHRBHTR3E
SCHEMBL8569563 0.74 HTR3E (0.75) MAPTHTR3EHTR3BHTR3AHTR3D
SCHEMBL22796395 0.74 HTR3E (0.53) TP53LMNAMAPTTHRBHTR3E
SCHEMBL15566619 0.74 GPR6 (0.69) SMN1; SMN2USP2CASP1CASP7
SCHEMBL8567791 0.73 HTR3E (0.74) MAPTHTR3EHTR3BHTR3AHTR3D
SCHEMBL8571641 0.73 HTR3E (0.64) TP53LMNAHTR3EHTR3BHTR3A

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-2020252195-A1 TELOMERASE REVERSE TRANSCRIPTASE DEGRADERS AND METHODS OF USE THEREOF THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2020-12-17 WO disclosed