SCHEMBL9808364

SCHEMBL9808364

CCCCCCC1(CCCCCCCN)CCCC1N

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43
EPHX1 P07099 1/20 0.43
SIGMAR1 Q99720 1/20 0.32
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31

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
SCHEMBL11367105 0.91 GNAI3 (0.32) GNAI3GNAO1GNAI1
SCHEMBL28545323 0.86 CYP1A2 (0.33) GNAI3GNAO1GNAI1
Bromide SCHEMBL28392876 0.84 CYP1A2 (0.32) GNAI3GNAO1GNAI1
Bromide SCHEMBL28388954 0.79 CYP1A2 (0.33)
SCHEMBL23650094 0.78 DNM1 (0.38) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL29061567 0.72 GNAI3 (0.31) GNAI3GNAO1GNAI1
SCHEMBL11097797 0.71 DNM1 (0.68) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL9762479 0.70 TDP1 (0.40) ALDH1A1EPHX1
SCHEMBL2426157 0.70 TDP1 (0.40) ALDH1A1EPHX1
SCHEMBL5339882 0.70 TDP1 (0.40) ALDH1A1EPHX1

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
EP-0425584-A1 PROSTAGLANDIN-DERIVATIVES HAVING ANTITHROMBOTIC ACTIVITY IBI- Istituto Biochimico Italiano Giovanni Lorenzini S.p.A. (IT) 1991-05-08 EP disclosed
WO-1990003170-A2 PROSTAGLANDIN-DERIVATIVES HAVING ANTITHROMBOTIC ACTIVITY IBI ISTITUTO BIOCHIMICO ITALIANO GIOVANNI LORENZINI S.P.A. (IT) 1990-04-05 WO disclosed