SCHEMBL17221925

SCHEMBL17221925

COc1ccc(CCNCc2cc(F)ccc2F)cc1OC

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.68
SMPD1 P17405 1/20 0.58
ALDH1A1 P00352 3/20 0.58
KDM4E B2RXH2 2/20 0.58
GLA P06280 1/20 0.58
KMT2A Q03164 6/20 0.57
MEN1 O00255 4/20 0.54
ATM Q13315 2/20 0.54
POLB P06746 2/20 0.54
ALOX15 P16050 1/20 0.53
TP53 P04637 1/20 0.50
THRB P10828 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA4 P22748 1/20 0.50
CA9 Q16790 1/20 0.50

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
SCHEMBL4103880 0.86 SMPD1 (0.69) SMN1; SMN2SMPD1ALDH1A1KDM4EGLA
SCHEMBL4109073 0.83 KDM4E (0.64) SMN1; SMN2SMPD1ALDH1A1KDM4EGLA
SCHEMBL4108962 0.80 MEN1 (0.67) SMN1; SMN2SMPD1ALDH1A1KDM4EGLA
SCHEMBL7435099 0.79 ATM (0.76) SMN1; SMN2SMPD1ALDH1A1KDM4EGLA
SCHEMBL28694522 0.78 SMPD1 (0.69) SMN1; SMN2SMPD1ALDH1A1KDM4EGLA
SCHEMBL4025101 0.78 KMT2A (0.65) SMN1; SMN2ALDH1A1KMT2AMEN1ATM
Hydrochloric Acid SCHEMBL11808765 0.77 ATM (0.73) SMN1; SMN2ALDH1A1KDM4EGLAKMT2A
Hydrochloric Acid SCHEMBL28691173 0.77 SMPD1 (0.67) SMN1; SMN2SMPD1ALDH1A1KDM4EGLA
SCHEMBL4103633 0.77 SMPD1 (0.70) SMN1; SMN2SMPD1ALDH1A1KDM4EGLA
SCHEMBL1581543 0.77 ATM (0.68) SMN1; SMN2ALDH1A1KDM4EKMT2AMEN1

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
US-9938525-B2 Compositions and methods for selective delivery of oligonucleotide molecules to cell types NLIFE THERAPEUTICS, S.L. (ES) 2018-04-10 US disclosed
US-20150315575-A1 COMPOSITIONS AND METHODS FOR SELECTIVE DELIVERY OF OLIGONUCLEOTIDE MOLECULES TO CELL TYPES PALOMO LIMITED (CY) 2015-11-05 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-20150315575-A1 COMPOSITIONS AND METHODS FOR SELECTIVE DELIVERY OF OLIGONUCLEOTIDE MOLECULES TO CELL TYPES MSR1, HAVCR2, SNRPE SMN1; SMN2 262/4885SMPD1 1732/4885ALDH1A1 4320/4885

“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.