SCHEMBL18649999

SCHEMBL18649999

O=C(NC1CCC1)OC1CCCCCCCCCC1

nearest known ligand 0.96

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 12/20 0.96
RAB9A P51151 3/20 0.52
NPC1 O15118 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
ALDH1A1 P00352 2/20 0.52
MAPT P10636 1/20 0.52
KDM4E B2RXH2 1/20 0.52
CYP3A4 P08684 1/20 0.52
EPHX2 P34913 1/20 0.52
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
BCHE P06276 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
SCHEMBL24067253 1.00 EPHX1 (0.96) EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL18650000 1.00 EPHX1 (0.96) EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL19729051 1.00 EPHX1 (0.96) EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL20365873 1.00 EPHX1 (0.96) EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL20365870 1.00 EPHX1 (0.96) EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL1824180 0.98 EPHX1 (1.00) EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL20528277 0.98 EPHX1 (1.00) EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL22669919 0.98 EPHX1 (1.00) EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL24067211 0.98 EPHX1 (1.00) EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL20528278 0.98 EPHX1 (1.00) EPHX1RAB9ANPC1SMN1; SMN2ALDH1A1

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-20210317235-A1 METHODS AND SYSTEMS FOR POLYMER PRECIPITATION AND GENERATION OF PARTICLES NOVARTIS AG (CH) 2021-10-14 US disclosed
US-20170362346-A1 METHODS AND SYSTEMS FOR POLYMER PRECIPITATION AND GENERATION OF PARTICLES CERULEAN PHARMA INC (US) 2017-12-21 US disclosed
US-9598503-B2 Methods and systems for polymer precipitation and generation of particles CERULEAN PHARMA INC. (US) 2017-03-21 US disclosed