SCHEMBL9616079

SCHEMBL9616079

C1CCC(N=C(NC2CCCCC2)NC2CCCCC2)CC1.c1ccc(N/C(=N\C2CCCCC2)NC2CCCCC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 3/20 0.59
▸ SMN1; SMN2 Q16637 6/20 0.56
▸ EPHX1 P07099 2/20 0.56
▸ EPHX2 P34913 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ MEN1 O00255 3/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ RECQL P46063 1/20 0.55
▸ THRB P10828 1/20 0.55
▸ LMNA P02545 4/20 0.51
▸ MAPT P10636 4/20 0.51
▸ GAA P10253 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ HPGD P15428 2/20 0.46
▸ BDKRB2 P30411 5/20 0.45
▸ HTT P42858 3/20 0.45
▸ ALOX12 P18054 3/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ TP53 P04637 1/20 0.45

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
SCHEMBL9616080 1.00 SIGMAR1 (0.59) SIGMAR1SMN1; SMN2EPHX1EPHX2RAB9A
SCHEMBL5621854 0.98 SMN1; SMN2 (0.58) SIGMAR1SMN1; SMN2EPHX1EPHX2RAB9A
SCHEMBL5621851 0.98 SMN1; SMN2 (0.58) SIGMAR1SMN1; SMN2EPHX1EPHX2RAB9A
SCHEMBL2740848 0.87 HPGD (0.51) SIGMAR1SMN1; SMN2EPHX1EPHX2RAB9A
SCHEMBL10493615 0.84 EPHX1 (0.63) SMN1; SMN2EPHX1EPHX2RAB9AMEN1
SCHEMBL10493613 0.84 EPHX1 (0.63) SMN1; SMN2EPHX1EPHX2RAB9AMEN1
SCHEMBL27776844 0.80 SMN1; SMN2 (0.58) SIGMAR1SMN1; SMN2EPHX1EPHX2RAB9A
SCHEMBL250080 0.80 SIGMAR1 (0.91) SIGMAR1SMN1; SMN2EPHX1EPHX2RAB9A
SCHEMBL20920144 0.78 SMN1; SMN2 (0.57) SMN1; SMN2EPHX1RAB9AMEN1KMT2A
SCHEMBL20920143 0.78 SMN1; SMN2 (0.57) SMN1; SMN2EPHX1RAB9AMEN1KMT2A

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
US-5124236-A Unsaturated compound, initiator of cationic dye with organic boron anion, thiol compound; for printing plates, resists FUJI PHOTO FILM CO., LTD. (JP) 1992-06-23 — — US disclosed
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