SCHEMBL5014624

SCHEMBL5014624

CCCCCCCCCC(CC)NCCC

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.42
EPHX1 P07099 1/20 0.42
LMNA P02545 3/20 0.39
CNR1 P21554 1/20 0.39
ADRA1A P35348 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ABCC3 O15438 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SIGMAR1 Q99720 3/20 0.36
ADH1B P00325 1/20 0.36
ADH1C P00326 1/20 0.36
ADH1A P07327 1/20 0.36
ADH4 P08319 1/20 0.36
ADH7 P40394 1/20 0.36
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
OPRM1 P35372 1/20 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
SCHEMBL20133597 1.00 DNM1 (0.42) DNM1EPHX1LMNACNR1ADRA1A
SCHEMBL20299289 1.00 DNM1 (0.42) DNM1EPHX1LMNACNR1ADRA1A
SCHEMBL117274 1.00 DNM1 (0.42) DNM1EPHX1LMNACNR1ADRA1A
Hydrochloric Acid SCHEMBL29286813 0.98 ABCC3 (0.41) DNM1EPHX1LMNACNR1ADRA1A
SCHEMBL11372470 0.98 DNM1 (0.41) DNM1EPHX1LMNACNR1ADRA1A
SCHEMBL3795916 0.95 LMNA (0.42) DNM1EPHX1LMNACNR1ADRA1A
SCHEMBL24353239 0.91 EPHX1 (0.48) DNM1EPHX1LMNACNR1ADRA1A
SCHEMBL9205945 0.91 EPHX1 (0.42) DNM1EPHX1LMNACNR1ADRA1A
SCHEMBL117250 0.91 EPHX1 (0.42) DNM1EPHX1LMNACNR1ADRA1A
SCHEMBL11699658 0.91 EPHX1 (0.48) DNM1EPHX1LMNACNR1ADRA1A

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-20080312112-A1 Lubricating formulations for dispersancy and temperature, friction, and wear reduction LYON DEVELOPMENT CORPORATION 2008-12-18 US disclosed
EP-0264247-A2 High functionality low molecular weight oil soluble dispersant additive useful in oleaginous compositions EXXON CHEMICAL PATENTS INC. (US) 1988-04-20 EP disclosed
EP-0001716-B1 TETRA-ORGANOTIN COMPOUNDS IN WHICH THE TIN IS BONDED TO THREE METHYL GROUPS AND IS BONDED DIRECTLY OR THROUGH A METHYLENE GROUP TO A BENZENE RING OR HETEROCYCLIC RADICAL M & T CHEMICALS, INC. (US) 1981-09-16 EP disclosed