SCHEMBL17572016

SCHEMBL17572016

O=C(O)c1ccc2c(c1)CCN(C(=O)CC1CC1)C2

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 3/20 0.57
NAMPT P43490 1/20 0.51
HDAC6 Q9UBN7 6/20 0.47
ALDH1A1 P00352 3/20 0.45
HDAC8 Q9BY41 1/20 0.44
KDM4E B2RXH2 4/20 0.44
MYC P01106 1/20 0.43
ENPP2 Q13822 1/20 0.43
NPSR1 Q6W5P4 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPC1 O15118 1/20 0.40

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
SCHEMBL13498398 0.95 NAMPT (0.57) PRMT5NAMPTHDAC6ALDH1A1HDAC8
SCHEMBL17560248 0.95 PRMT5 (0.57) PRMT5NAMPTHDAC6ALDH1A1KDM4E
SCHEMBL17560156 0.89 NAMPT (0.58) PRMT5NAMPTHDAC6ALDH1A1HDAC8
SCHEMBL1264708 0.87 HDAC6 (0.63) PRMT5HDAC6HDAC8
SCHEMBL17560153 0.85 PRMT5 (0.56) PRMT5NAMPTHDAC6ALDH1A1HDAC8
SCHEMBL17572220 0.83 PRMT5 (0.50) PRMT5NAMPTALDH1A1KDM4ENPSR1
SCHEMBL17560252 0.83 ABHD6 (0.51) PRMT5NAMPTHDAC6ALDH1A1KDM4E
SCHEMBL1263315 0.83 HDAC6 (0.67) PRMT5NAMPTHDAC6HDAC8
SCHEMBL17560159 0.80 PRMT5 (0.56) PRMT5NAMPTHDAC6ALDH1A1HDAC8
SCHEMBL19356271 0.80 PRMT5 (0.50) PRMT5NAMPTALDH1A1KDM4ENPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10005792-B2 Aminoindane-, aminotetrahydronaphthalene- and aminobenzocyclobutane-derived PRMT5-inhibitors CTXT PTY. LTD. (AU) 2018-06-26 US disclosed
US-10005792-B2 Aminoindane-, aminotetrahydronaphthalene- and aminobenzocyclobutane-derived PRMT5-inhibitors CTXT PTY. LTD. (AU) 2018-06-26 US disclosed
US-20170313713-A1 AMINOINDANE-, AMINOTETRAHYDRONAPHTHALENE- AND AMINOBENZOCYCLOBUTANE-DERIVED PRMT5-INHIBITORS CTXT PTY. LTD. (AU) 2017-11-02 US disclosed
US-20170313713-A1 AMINOINDANE-, AMINOTETRAHYDRONAPHTHALENE- AND AMINOBENZOCYCLOBUTANE-DERIVED PRMT5-INHIBITORS CTXT PTY. LTD. (AU) 2017-11-02 US disclosed
WO-2016034671-A1 AMINOINDANE-, AMINOTETRAHYDRONAPHTHALENE- AND AMINOBENZOCYCLOBUTANE-DERIVED PRMT5-INHIBITORS CTXT PTY LTD (AU) 2016-03-10 WO 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-10005792-B2 Aminoindane-, aminotetrahydronaphthalene- and aminobenzocyclobutane-derived PRMT5-inhibitors PRMT5, PRMT1, PRMT3 PRMT5 1/4885NAMPT 3991/4885HDAC6 2090/4885
US-20170313713-A1 AMINOINDANE-, AMINOTETRAHYDRONAPHTHALENE- AND AMINOBENZOCYCLOBUTANE-DERIVED PRMT5-INHIBITORS PRMT5, PRMT1, PRMT3 PRMT5 1/4885NAMPT 3830/4885HDAC6 2069/4885

“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.