SCHEMBL13780680

SCHEMBL13780680

CC(=O)CCCc1cc2cccc3ccc4cccc1c4c32

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.60
MEN1 O00255 2/20 0.60
MTNR1A P48039 3/20 0.42
KDM4E B2RXH2 3/20 0.41
HPGD P15428 3/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
CYP1A2 P05177 3/20 0.40
ERBB2 P04626 1/20 0.40
FYN P06241 1/20 0.40
MAOA P21397 1/20 0.40
ACHE P22303 1/20 0.40
AHR P35869 1/20 0.40
CYP2D6 P10635 2/20 0.39
GLA P06280 1/20 0.39
POLB P06746 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
IAPP P10997 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
SCHEMBL9911142 0.89 KMT2A (0.74) KMT2AMEN1MTNR1AKDM4EHPGD
SCHEMBL9334268 0.87 KMT2A (0.80) KMT2AMEN1MTNR1AKDM4EHPGD
SCHEMBL13077932 0.86 KMT2A (0.57) KMT2AMEN1MTNR1AKDM4EHPGD
SCHEMBL9911140 0.85 KMT2A (0.68) KMT2AMEN1MTNR1AKDM4EHPGD
SCHEMBL9911141 0.85 KMT2A (0.68) KMT2AMEN1MTNR1AKDM4EHPGD
SCHEMBL14438597 0.81 CYP1A2 (0.49) KMT2AMEN1MTNR1AKDM4EHPGD
SCHEMBL28571050 0.81 KMT2A (0.67) KMT2AMEN1MTNR1AKDM4EHPGD
SCHEMBL498807 0.81 KMT2A (0.71) KMT2AMEN1KDM4EHPGDALDH1A1
SCHEMBL2177707 0.80 MEN1 (0.47) KMT2AMEN1KDM4EHPGDALDH1A1
SCHEMBL10905518 0.78 KMT2A (0.77) KMT2AMEN1MTNR1AKDM4EHPGD

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-9572891-B2 Oligonucleotide conjugates GERON CORPORATION (US) 2017-02-21 US disclosed
US-20150374841-A1 Oligonucleotide Conjugates GERON CORPORATION 2015-12-31 US disclosed
US-9072790-B2 Oligonucleotide conjugates GERON CORPORATION (US) 2015-07-07 US disclosed
US-20130253042-A1 Oligonucleotide Conjugates GERON CORPORATION (US) 2013-09-26 US disclosed
EP-2114462-B1 Compounds for fluorescence imaging UNIV GENEVE (CH) 2013-06-05 EP disclosed
US-8440635-B2 Oligonucleotide conjugates GERON CORPORATION (US) 2013-05-14 US disclosed
US-7563618-B2 Oligonucleotide conjugates GERON CORPORATION (US) 2009-07-21 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 (2 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-20150374841-A1 Oligonucleotide Conjugates TERT, RNGTT, TRDMT1 KMT2A 640/4885MEN1 2881/4885MTNR1A 2056/4885
US-20130253042-A1 Oligonucleotide Conjugates TERT, RNGTT, TRDMT1 KMT2A 640/4885MEN1 2881/4885MTNR1A 2056/4885

“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.