SCHEMBL11066256

SCHEMBL11066256

C=Cc1ccccc1CC.CCNc1cccc2c1ccc1ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.39
ALDH1A1 P00352 5/20 0.39
MEN1 O00255 4/20 0.39
LMNA P02545 2/20 0.39
IDO1 P14902 1/20 0.38
CA12 O43570 2/20 0.36
CA4 P22748 2/20 0.36
CA7 P43166 2/20 0.36
CA9 Q16790 2/20 0.36
CA14 Q9ULX7 2/20 0.36
ATM Q13315 1/20 0.36
CA3 P07451 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA5B Q9Y2D0 1/20 0.35
AR P10275 1/20 0.35
HPRT1 P00492 1/20 0.35
TSHR P16473 2/20 0.35
HSD17B10 Q99714 2/20 0.35
RECQL P46063 1/20 0.35

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
SCHEMBL10628388 0.87 IDO1 (0.35) KMT2AALDH1A1MEN1LMNAIDO1
SCHEMBL11061590 0.84 MEN1 (0.38) KMT2AALDH1A1MEN1LMNAIDO1
SCHEMBL27531775 0.82 IDO1 (0.53) KMT2AALDH1A1MEN1LMNAIDO1
Styrene SCHEMBL10623935 0.82 IDO1 (0.42) KMT2AALDH1A1MEN1LMNAIDO1
SCHEMBL10558460 0.79 SIRT2 (0.43) KMT2AALDH1A1MEN1LMNAATM
Naphthalene SCHEMBL28223152 0.74 ALDH1A1 (0.40) KMT2AALDH1A1MEN1LMNAATM
SCHEMBL6849255 0.74 ALDH1A1 (0.43) KMT2AALDH1A1MEN1LMNATSHR
SCHEMBL60765 0.72 CA12 (0.60) KMT2AALDH1A1MEN1LMNAIDO1
SCHEMBL8590907 0.72 ALDH1A1 (0.41) KMT2AALDH1A1MEN1LMNAMAPT
SCHEMBL29828333 0.72 CA12 (0.60) KMT2AALDH1A1MEN1LMNAIDO1

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-4473630-A Liquid developer comprising aminoalkyl styrene polymer for electrostatic images FUJI PHOTO FILM CO., LTD. (JP) 1984-09-25 US disclosed