SCHEMBL10899320

SCHEMBL10899320

CCc1ccc(/C=C2/NC(C)OC2=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.44
PIM1 P11309 1/20 0.44
PIM2 Q9P1W9 1/20 0.44
MYC P01106 4/20 0.40
MAX P61244 4/20 0.40
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
LMNA P02545 5/20 0.39
MAPT P10636 5/20 0.39
SMN1; SMN2 Q16637 5/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
KDM4E B2RXH2 4/20 0.39
HTT P42858 4/20 0.39
TDP1 Q9NUW8 2/20 0.39
NPSR1 Q6W5P4 3/20 0.37
ATM Q13315 2/20 0.37
XBP1 P17861 1/20 0.37
CISD1 Q9NZ45 1/20 0.36
ALDH1A1 P00352 2/20 0.36

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
SCHEMBL10898389 0.83 SMN1; SMN2 (0.41) PIM1PIM2RAB9ANPC1LMNA
SCHEMBL8958542 0.82 LMNA (0.43) PIM1PIM2LMNAMAPTSMN1; SMN2
SCHEMBL8402323 0.81 ALPL (0.40) PIM1PIM2LMNAMAPTSMN1; SMN2
SCHEMBL10900715 0.81 PIM1 (0.48) PIM1PIM2RAB9ANPC1LMNA
SCHEMBL10901430 0.75 ABCC4 (0.48) IGF1RLMNAMAPTMEN1KMT2A
SCHEMBL10900026 0.74 MAPT (0.47) RAB9ANPC1LMNAMAPTSMN1; SMN2
SCHEMBL10896573 0.71 DYRK2 (0.54) PIM1LMNAMAPTSMN1; SMN2MEN1
SCHEMBL8216537 0.68 GSK3B (0.65) IGF1RPIM1PIM2MYCMAX
SCHEMBL8216533 0.68 GSK3B (0.65) IGF1RPIM1PIM2MYCMAX
SCHEMBL13563893 0.68 ALDH1A1 (0.61) IGF1RPIM1PIM2MYCMAX

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-4612388-A Process for producing N-acylphenylalanines MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1986-09-16 US claimed
US-4612388-A Process for producing N-acylphenylalanines MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1986-09-16 US disclosed
EP-0161796-A1 Process for producing N-acylphenylalanines MITSUI TOATSU CHEMICALS, Inc. (JP) 1985-11-21 EP disclosed