SCHEMBL13856009

SCHEMBL13856009

CCN(C)CCCCN(C)CCCCNC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.44
PRMT3 O60678 1/20 0.40
CARM1 Q86X55 1/20 0.40
PRMT6 Q96LA8 1/20 0.40
PRMT1 Q99873 1/20 0.40
PRMT8 Q9NR22 1/20 0.40
S1PR2 O95136 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
S1PR5 Q9H228 1/20 0.39
KDM4C Q9H3R0 9/20 0.39
KDM5A P29375 7/20 0.39
CHRM2 P08172 2/20 0.37
GGPS1 O95749 1/20 0.32
FDPS P14324 1/20 0.32
AGTR1 P30556 1/20 0.32
OPRM1 P35372 1/20 0.32
PDE3A Q14432 1/20 0.32
KDM4A O75164 2/20 0.32
KDM5C P41229 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
SCHEMBL16475529 1.00 EPHX1 (0.44) EPHX1PRMT3CARM1PRMT6PRMT1
SCHEMBL22343848 0.98 EPHX1 (0.46) EPHX1PRMT3CARM1PRMT6PRMT1
SCHEMBL19245115 0.95 EPHX1 (0.50) EPHX1PRMT3CARM1PRMT6PRMT1
SCHEMBL22564674 0.95 EPHX1 (0.50) EPHX1PRMT3CARM1PRMT6PRMT1
SCHEMBL17001500 0.95 EPHX1 (0.50) EPHX1PRMT3CARM1PRMT6PRMT1
SCHEMBL25004071 0.91 PRMT3 (0.40) EPHX1PRMT3CARM1PRMT6PRMT1
SCHEMBL3316663 0.90
SCHEMBL25075475 0.90 PRMT3 (0.48) EPHX1PRMT3CARM1PRMT6PRMT1
SCHEMBL22946807 0.87 EPHX1 (0.50) EPHX1PRMT3CARM1PRMT6PRMT1
SCHEMBL13540767 0.87 PRMT3 (0.46) EPHX1PRMT3CARM1PRMT6PRMT1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170065541-A1 SYNTHESIS AND GROWTH REGULATORY ACTIVITY OF A PROTOTYPE MEMBER OF A NEW FAMILY OF AMINOTHIOL RADIOPROTECTORS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2017-03-09 US disclosed
US-9458100-B2 Synthesis and growth regulatory activity of a prototype member of a new family of aminothiol radioprotectors WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2016-10-04 US disclosed
US-20160243062-A1 SYNTHESIS AND GROWTH REGULATORY ACTIVITY OF A PROTOTYPE MEMBER OF A NEW FAMILY OF AMINOTHIOL RADIOPROTECTORS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2016-08-25 US disclosed
US-20140107216-A1 SYNTHESIS AND GROWTH REGULATORY ACTIVITY OF A PROTOTYPE MEMBER OF A NEW FAMILY OF AMlNOTHIOL RADIOPROTECTORS WISCONSIN ALUMNI RESEARCH FOUNDATION 2014-04-17 US disclosed
US-20140107217-A1 SYNTHESIS AND GROWTH REGULATORY ACTIVITY OF A PROTOTYPE MEMBER OF A NEW FAMILY OF AMlNOTHIOL RADIOPROTECTORS WISCONSIN ALUMNI RESEARCH FOUNDATION 2014-04-17 US disclosed
US-20090124832-A1 OLIGOAMINE COMPOUNDS AND DERIVATIVES THEREOF FOR CANCER THERAPY PROGEN PHARMACEUTICALS, INC. (US) 2009-05-14 US disclosed
US-7491849-B2 Oligoamine compounds and derivatives thereof for cancer therapy PROGEN PHARMACEUTICALS, INC. (US) 2009-02-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140107216-A1 SYNTHESIS AND GROWTH REGULATORY ACTIVITY OF A PROTOTYPE MEMBER OF A NEW FAMILY OF AMlNOTHIOL RADIOPROTECTORS ROS1, PRMT1, MCL1 EPHX1 3166/4885PRMT3 4/4885CARM1 119/4885
US-20170065541-A1 SYNTHESIS AND GROWTH REGULATORY ACTIVITY OF A PROTOTYPE MEMBER OF A NEW FAMILY OF AMINOTHIOL RADIOPROTECTORS ROS1, PRMT1, RNF10 EPHX1 4337/4885PRMT3 5/4885CARM1 388/4885
US-20090124832-A1 OLIGOAMINE COMPOUNDS AND DERIVATIVES THEREOF FOR CANCER THERAPY THOP1, OAT, DUT EPHX1 4519/4885PRMT3 2770/4885CARM1 2440/4885
US-20140107217-A1 SYNTHESIS AND GROWTH REGULATORY ACTIVITY OF A PROTOTYPE MEMBER OF A NEW FAMILY OF AMlNOTHIOL RADIOPROTECTORS ROS1, PRMT1, MCL1 EPHX1 3166/4885PRMT3 4/4885CARM1 119/4885
US-20160243062-A1 SYNTHESIS AND GROWTH REGULATORY ACTIVITY OF A PROTOTYPE MEMBER OF A NEW FAMILY OF AMINOTHIOL RADIOPROTECTORS ROS1, RNF10, PRMT1 EPHX1 4398/4885PRMT3 4/4885CARM1 425/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.