SCHEMBL11575424

SCHEMBL11575424

CCCN1CCC(NN)CC1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.46
DRD2 P14416 3/20 0.43
EPHX1 P07099 1/20 0.43
EPHX2 P34913 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GNAI3 P08754 2/20 0.41
GNAO1 P09471 2/20 0.41
GNAI1 P63096 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ROCK2 O75116 1/20 0.38
ROCK1 Q13464 1/20 0.38
POLB P06746 1/20 0.38
HTT P42858 1/20 0.38
UBE2M P61081 1/20 0.38
DCUN1D1 Q96GG9 1/20 0.38

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
SCHEMBL27949996 0.88 GNAO1 (0.52) EPHX1EPHX2GNAI3GNAO1GNAI1
SCHEMBL18065736 0.82 SMN1; SMN2 (0.47) EPHX1EPHX2L3MBTL1MEN1KMT2A
SCHEMBL1111914 0.80 PABPC1 (0.47) PABPC1DRD2EPHX1EPHX2L3MBTL1
SCHEMBL22878502 0.78 PABPC1 (0.46) PABPC1DRD2EPHX1EPHX2L3MBTL1
SCHEMBL4547142 0.78 KDM1A (0.48) PABPC1POLBHTT
SCHEMBL20492763 0.77 PABPC1 (0.45) PABPC1DRD2EPHX1EPHX2L3MBTL1
SCHEMBL26412504 0.75 PABPC1 (0.44) PABPC1DRD2EPHX1EPHX2L3MBTL1
SCHEMBL27013488 0.75 PABPC1 (0.44) PABPC1DRD2EPHX1EPHX2L3MBTL1
SCHEMBL20649667 0.75 EPHX1 (0.48) PABPC1DRD2EPHX1EPHX2L3MBTL1
SCHEMBL7220679 0.75 GNAI3 (0.67) PABPC1DRD2GNAI3GNAO1GNAI1

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-9227917-B2 Amine-containing lipidoids and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-01-05 US disclosed
US-4179439-A Rifamycins and method for their preparation INTREPRINDEREA DE ANTIBIOTICE IASI (RO) 1979-12-18 US disclosed