SCHEMBL20169328

SCHEMBL20169328

CCC(C)(N)c1ccc(C(C)(N)CC)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
KMT2A Q03164 1/20 0.42
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
ESR1 P03372 4/20 0.39
ESR2 Q92731 4/20 0.39
TAAR1 Q96RJ0 2/20 0.39
SLC6A2 P23975 1/20 0.39
PDE2A O00408 1/20 0.36
TACR1 P25103 1/20 0.35
KCNN4 O15554 1/20 0.35
AR P10275 2/20 0.34
RORC P51449 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL14272169 0.92 PDE2A (0.46) MEN1CYP1A2KMT2ANPC1MAPT
SCHEMBL18826628 0.92 PDE2A (0.46) MEN1CYP1A2KMT2ANPC1MAPT
SCHEMBL19480335 0.92 TSHR (0.46) MEN1CYP1A2KMT2ANPC1MAPT
SCHEMBL12038270 0.90 TSHR (0.50) MEN1CYP1A2KMT2ANPC1MAPT
SCHEMBL18896109 0.90 ESR1 (0.44) MEN1CYP1A2KMT2ANPC1MAPT
SCHEMBL155932 0.89 TAAR1 (0.52) CYP1A2KMT2AMAPTESR1ESR2
SCHEMBL7905302 0.88 KCNN4 (0.39) MEN1CYP1A2KMT2ANPC1MAPT
SCHEMBL10656617 0.88 ESR1 (0.58) ESR1ESR2SLC6A2ARTSHR
SCHEMBL10160572 0.88 CA1 (0.36) MEN1CYP1A2KMT2ANPC1MAPT
SCHEMBL8760835 0.88 SLC6A2 (0.48) MEN1KMT2ASLC6A2TSHR

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
US-10626218-B2 Alkoxysilane-modified polyamic acid solution, laminate and flexible device each produced using same, and method for producing laminate KANEKA CORPORATION (JP) 2020-04-21 US disclosed
US-9976085-B2 Liquid crystal alignment agent, liquid crystal alignment film, and liquid crystal display element CHI MEI CORPORATION (TW) 2018-05-22 US disclosed