SCHEMBL3604016

SCHEMBL3604016

O=C(O)c1cn(CCOC2CCCCO2)c2c1CCc1cnccc1-2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ICAM1 P05362 1/20 0.34
SELE P16581 1/20 0.34
KDM4C Q9H3R0 4/20 0.33
CCNA2 P20248 3/20 0.33
CDK2 P24941 3/20 0.33
CCNA1 P78396 3/20 0.33
EP300 Q09472 1/20 0.33
CREBBP Q92793 1/20 0.33
PLK1 P53350 1/20 0.33
NAMPT P43490 1/20 0.33
ROCK2 O75116 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CCNC P24863 1/20 0.31
CDK8 P49336 1/20 0.31
HASPIN Q8TF76 1/20 0.31
MET P08581 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 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
SCHEMBL3603816 0.91 PLK1 (0.35) MEN1KMT2AICAM1SELEKDM4C
SCHEMBL3601841 0.82 ROCK2 (0.35) CCNA2CDK2CCNA1EP300CREBBP
SCHEMBL3601843 0.82 ROCK2 (0.35) CCNA2CDK2CCNA1EP300CREBBP
SCHEMBL3590777 0.78 PIM1 (0.43) MEN1KMT2AKDM4CCCNA2CDK2
SCHEMBL3600299 0.75 KDM4E (0.34) MEN1KMT2AKDM4CCCNA2CDK2
SCHEMBL3596791 0.74 CCNA2 (0.41) MEN1KMT2AKDM4CCCNA2CDK2
SCHEMBL3601640 0.73 CYP3A4 (0.38) CCNA2CDK2CCNA1
SCHEMBL8296604 0.70 MEN1 (0.47) MEN1KMT2AICAM1SELEKDM4C
SCHEMBL23216316 0.67 MEN1 (0.58) MEN1KMT2AKDM4CEP300CREBBP
SCHEMBL29886721 0.67 MEN1 (0.47) MEN1KMT2AKDM4CEP300CREBBP

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
EP-2118102-B1 TRICYCLIC INDOLES AND (4,5-DIHYDRO) INDOLES NERVIANO MEDICAL SCIENCES SRL (IT) 2013-06-12 EP disclosed
US-8207180-B2 Tricyclic indoles and (4,5-dihydro) indoles NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-06-26 US disclosed
US-20100075998-A1 TRICYCLIC INDOLES AND (4,5-DIHYDRO) INDOLES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-03-25 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 (1 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-20100075998-A1 TRICYCLIC INDOLES AND (4,5-DIHYDRO) INDOLES CDC7, CDK7, CDK17 MEN1 1222/4885KMT2A 2454/4885ICAM1 4642/4885

“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.