SCHEMBL4409296

SCHEMBL4409296

CCOC(=O)c1cn([C@H](CO)C(C)C)c2cc(OC)c(Br)cc2c1=O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 1/20 0.49
▸ LMNA P02545 3/20 0.45
▸ ALDH1A1 P00352 5/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ KMT2A Q03164 4/20 0.39
▸ HTT P42858 1/20 0.38
▸ RAD52 P43351 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 3/20 0.37
▸ P4HB P07237 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.36
▸ GABRA1 P14867 1/20 0.35
▸ GABRB1 P18505 1/20 0.35
▸ GABRA3 P34903 1/20 0.35
▸ GABRB2 P47870 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ DPP4 P27487 1/20 0.35

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
SCHEMBL16482335 0.91 METTL3 (0.51) METTL3LMNAALDH1A1L3MBTL1KMT2A
SCHEMBL18240294 0.91 METTL3 (0.51) METTL3LMNAALDH1A1L3MBTL1KMT2A
SCHEMBL16485625 0.89 METTL3 (0.47) METTL3LMNAALDH1A1L3MBTL1KMT2A
SCHEMBL12413578 0.89 LMNA (0.47) METTL3LMNAALDH1A1KMT2APOLB
SCHEMBL20343895 0.88 LMNA (0.42) METTL3LMNAALDH1A1L3MBTL1KMT2A
SCHEMBL1301920 0.88 METTL3 (0.61) METTL3ALDH1A1L3MBTL1KMT2ATSHR
SCHEMBL3500150 0.87 KMT2A (0.48) METTL3LMNAALDH1A1KMT2AHTT
SCHEMBL13225661 0.87 KMT2A (0.48) METTL3LMNAALDH1A1KMT2AHTT
SCHEMBL12108816 0.87 LMNA (0.46) METTL3LMNAALDH1A1KMT2APOLB
SCHEMBL31419629 0.87 KMT2A (0.48) METTL3LMNAALDH1A1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130345462-A1 PROCESS FOR PRODUCTION OF 4-OXOQUINOLINE COMPOUND JAPAN TOBACCO INC. (JP) 2013-12-26 — — US disclosed
US-8420821-B2 Process for production of 4-oxoquinoline compound JAPAN TOBACCO INC. (JP) 2013-04-16 — — US disclosed
US-8420821-B2 Process for production of 4-oxoquinoline compound JAPAN TOBACCO INC. (JP) 2013-04-16 — — US disclosed
US-8420821-B2 Process for production of 4-oxoquinoline compound JAPAN TOBACCO INC. (JP) 2013-04-16 — — US disclosed
US-20110269741-A1 NOVEL COMPOSITIONS AND METHODS OF USE ARDEA BIOSCIENCES, INC. (US) 2011-11-03 — — US disclosed
US-20110166123-A1 NOVEL COMPOSITIONS AND METHODS OF USE AARDEA BIOSCIENCES, INC. (US) 2011-07-07 — — US disclosed
US-20090318702-A1 PROCESS FOR PRODUCTION OF 4-OXOQUINOLINE COMPOUND SHIONOGI & CO., LTD. (JP) 2009-12-24 — — US disclosed
US-20090318702-A1 PROCESS FOR PRODUCTION OF 4-OXOQUINOLINE COMPOUND SHIONOGI & CO., LTD. (JP) 2009-12-24 — — US disclosed
US-20090318702-A1 PROCESS FOR PRODUCTION OF 4-OXOQUINOLINE COMPOUND SHIONOGI & CO., LTD. (JP) 2009-12-24 — — 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 (4 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-20130345462-A1 PROCESS FOR PRODUCTION OF 4-OXOQUINOLINE COMPOUND CYP4X1, CYP3A4, CYP3A7 METTL3 1453/4885LMNA 2635/4885ALDH1A1 1354/4885
US-20110166123-A1 NOVEL COMPOSITIONS AND METHODS OF USE TYMP, SAMHD1, PNP METTL3 2709/4885LMNA 1312/4885ALDH1A1 1976/4885
US-20090318702-A1 PROCESS FOR PRODUCTION OF 4-OXOQUINOLINE COMPOUND CYP4X1, CYP3A4, CYP3A7 METTL3 1453/4885LMNA 2635/4885ALDH1A1 1354/4885
US-20110269741-A1 NOVEL COMPOSITIONS AND METHODS OF USE TYMP, SAMHD1, PNP METTL3 2709/4885LMNA 1312/4885ALDH1A1 1976/4885

“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.

Send feedback