SCHEMBL7435733

SCHEMBL7435733

CNCC(O)CN1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.60
ACHE P22303 3/20 0.55
CARM1 Q86X55 6/20 0.52
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
LMNA P02545 3/20 0.49
OPRM1 P35372 3/20 0.49
CYP2D6 P10635 2/20 0.49
HIF1A Q16665 2/20 0.49
MAPT P10636 2/20 0.49
HTR1A P08908 2/20 0.49
DRD2 P14416 2/20 0.49
RECQL P46063 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
MAPK1 P28482 1/20 0.49
THPO P40225 1/20 0.49
CACNA1G O43497 1/20 0.49
CACNA1H O95180 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
SCHEMBL7439416 0.86 IGF1R (0.57) IGF1RACHEMEN1KMT2ALMNA
SCHEMBL7446980 0.85 IGF1R (0.56) IGF1RACHEMEN1KMT2ALMNA
SCHEMBL7267603 0.82 IGF1R (0.66) IGF1RACHEMEN1KMT2ALMNA
SCHEMBL7754375 0.82 IGF1R (0.55) IGF1RACHEMEN1KMT2ALMNA
SCHEMBL7267783 0.81 IGF1R (0.64) IGF1RACHEMEN1KMT2ALMNA
SCHEMBL7276482 0.81 IGF1R (0.64) IGF1RACHEMEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL7548578 0.81 IGF1R (0.54) IGF1RACHEMEN1KMT2ALMNA
SCHEMBL14355260 0.81 IGF1R (0.60) IGF1RACHEMEN1KMT2ALMNA
Water SCHEMBL7275823 0.80 IGF1R (0.63) IGF1RACHEMEN1KMT2ALMNA
SCHEMBL8612798 0.80 IGF1R (0.53) IGF1RMEN1KMT2ALMNAOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5164390-A Cardiac disorders ORTHO PHARMACEUTICAL CORPORATION (US) 1992-11-17 US disclosed
US-5021574-A Cardiotonic agents, antiarrhythmia agents ORTHO PHARMACEUTICAL CORPORATION (US) 1991-06-04 US disclosed
US-5001127-A 4-substituted pyrazolo[3,4-d]pyrimidine derivatives ORTHO PHARMACEUTICAL CORPORATION (US) 1991-03-19 US disclosed