SCHEMBL9220591

SCHEMBL9220591

CCOC(=O)N1CCCC1CC

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
L3MBTL1 Q9Y468 3/20 0.44
POLB P06746 1/20 0.44
RAB9A P51151 3/20 0.44
ALDH1A1 P00352 4/20 0.44
ATM Q13315 2/20 0.42
THRB P10828 1/20 0.42
MAPT P10636 1/20 0.42
GAA P10253 1/20 0.42
NPC1 O15118 2/20 0.42
HPGD P15428 2/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.40
TSHR P16473 1/20 0.40
NPSR1 Q6W5P4 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
SCHEMBL20693641 1.00 KDM4E (0.47) KDM4EL3MBTL1POLBRAB9AALDH1A1
SCHEMBL21057416 0.95 KDM4E (0.52) KDM4EL3MBTL1RAB9AALDH1A1ATM
SCHEMBL10118460 0.89 L3MBTL1 (0.46) KDM4EL3MBTL1POLBRAB9AALDH1A1
SCHEMBL21702576 0.87 L3MBTL1 (0.61) KDM4EL3MBTL1POLBRAB9AALDH1A1
SCHEMBL14501994 0.87 L3MBTL1 (0.61) KDM4EL3MBTL1POLBRAB9AALDH1A1
SCHEMBL8416943 0.87 L3MBTL1 (0.61) KDM4EL3MBTL1POLBRAB9AALDH1A1
SCHEMBL12437188 0.86 RAB9A (0.42) KDM4EL3MBTL1POLBRAB9AALDH1A1
SCHEMBL4744377 0.85 KMT2A (0.46) KDM4EL3MBTL1POLBRAB9AALDH1A1
SCHEMBL14294016 0.85 KMT2A (0.46) KDM4EL3MBTL1POLBRAB9AALDH1A1
SCHEMBL14144107 0.85 POLB (0.45) KDM4EL3MBTL1POLBRAB9AALDH1A1

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-10370358-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2019-08-06 US disclosed
US-20180194746-A1 Compounds For the Treatment of HIV GILEAD SCIENCES, INC. 2018-07-12 US disclosed
EP-0320032-B1 Pyridizinamine derivatives JANSSEN PHARMACEUTICA NV (BE) 1995-01-18 EP disclosed
US-5231184-A Viricide intermediate JANSSEN PHARMACEUTICA N.V. (BE) 1993-07-27 US disclosed
US-5106973-A Viricide intermediates JANSSEN PHARMACEUTICA N.V. (BE) 1992-04-21 US disclosed
US-4992433-A Viricides JANSSEN PHARMACEUTICA N.V. (BE) 1991-02-12 US disclosed
EP-0320032-A1 Pyridizinamine derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1989-06-14 EP 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-10370358-B2 Compounds for the treatment of HIV CCR5, NPC1, FURIN KDM4E 1590/4885L3MBTL1 4307/4885POLB 1747/4885
US-20180194746-A1 Compounds For the Treatment of HIV CCR5, NPC1, FURIN KDM4E 1590/4885L3MBTL1 4307/4885POLB 1747/4885

“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.