SCHEMBL8159508

SCHEMBL8159508

CCC(N)N1CCN(c2ccc(F)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.53
MAPT P10636 4/20 0.53
ALDH1A1 P00352 2/20 0.53
MAPK1 P28482 1/20 0.53
HTT P42858 1/20 0.53
GFER P55789 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
DHFR P00374 2/20 0.46
TP53 P04637 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
RAD52 P43351 1/20 0.44
POLB P06746 3/20 0.43
RECQL P46063 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL7839832 0.80 MAPT (0.49) LMNAMAPTALDH1A1MAPK1HTT
SCHEMBL10367148 0.80 LMNA (0.49) LMNAMAPTALDH1A1MAPK1HTT
SCHEMBL8334018 0.80 MAPT (0.49) LMNAMAPTALDH1A1MAPK1HTT
SCHEMBL12582119 0.77 MAPT (0.67) LMNAMAPTALDH1A1MAPK1HTT
SCHEMBL7331424 0.77 MAPT (0.49) LMNAMAPTALDH1A1MAPK1HTT
SCHEMBL8339624 0.76 KDM4E (0.53) LMNAMAPTALDH1A1MAPK1HTT
SCHEMBL11550587 0.76 MAPT (0.61) LMNAMAPTALDH1A1MAPK1HTT
SCHEMBL13875129 0.75 MEN1 (0.62) LMNAMAPTTDP1MEN1KMT2A
SCHEMBL10373626 0.75 MAPT (0.77) LMNAMAPTALDH1A1MAPK1HTT
SCHEMBL21243979 0.74 ALDH1A1 (0.49) LMNAMAPTALDH1A1MAPK1HTT

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-2000005206-A1 ARYLPIPERAZINE DERIVATIVES USEFUL AS URO-SELECTIVE ALPHA-1-ADRENOCEPTOR BLOCKERS RANBAXY LABORATORIES LIMITED (US) 2000-02-03 WO disclosed