SCHEMBL8370595

SCHEMBL8370595

[CH2]CCN1CCN(c2cc(C)ccc2C)CC1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
ALDH1A1 P00352 2/20 0.58
TSHR P16473 2/20 0.58
HTT P42858 2/20 0.58
HTR1A P08908 1/20 0.54
ADRA1A P35348 1/20 0.54
ADRA1B P35368 1/20 0.54
TP53 P04637 3/20 0.53
DRD4 P21917 3/20 0.53
DRD2 P14416 2/20 0.53
DRD3 P35462 2/20 0.53
POLB P06746 2/20 0.49
MAPK1 P28482 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 4/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GAA P10253 1/20 0.47

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
SCHEMBL18181904 0.81 TSHR (0.63) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL7597607 0.81 MEN1 (0.67) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL11392447 0.81 MEN1 (0.67) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL10415957 0.80 ADRA1B (0.57) MEN1KMT2AALDH1A1HTR1AADRA1A
SCHEMBL13292998 0.79 MEN1 (0.57) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL13140375 0.79 MEN1 (0.64) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL29342004 0.79 MEN1 (0.64) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL4725263 0.78 DRD2 (0.60) MEN1KMT2AALDH1A1TSHRHTT
Ammonia Solution, Strong SCHEMBL3580502 0.78 MEN1 (0.55) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL18177816 0.77 ALDH1A1 (0.58) MEN1KMT2AALDH1A1TSHRHTT

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-0891344-A1 ALPHA 1-ADRENERGIC RECEPTOR ANTAGONISTS SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 1999-01-20 EP disclosed
WO-1997037983-A1 α1-ADRENERGIC RECEPTOR ANTAGONISTS SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 1997-10-16 WO disclosed