SCHEMBL14611643

SCHEMBL14611643

CCOC(=O)c1cn(CCCC(C)(C)[Si](C)(C)O)c2c([N+](=O)[O-])cc(Cc3cccc(Cl)c3F)cc2c1=O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ LMNA P02545 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ POLB P06746 1/20 0.43
▸ NPC1 O15118 1/20 0.39
▸ CNR1 P21554 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ STAT3 P40763 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ P2RX3 P56373 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ HPGD P15428 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ GNRHR P30968 2/20 0.32

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
SCHEMBL14611641 0.92 POLB (0.38) ALDH1A1LMNAMAPTPOLBNPC1
SCHEMBL14611570 0.89 KMT2A (0.34) ALDH1A1LMNAMAPTPOLBKMT2A
SCHEMBL11956462 0.88 STAT3 (0.35) ALDH1A1LMNAMAPTPOLBKMT2A
SCHEMBL11948586 0.87 ALDH1A1 (0.44) ALDH1A1LMNAMAPTPOLBNPC1
SCHEMBL11957341 0.85 CMA1 (0.39) ALDH1A1LMNAMAPTPOLBKMT2A
SCHEMBL11956924 0.81 KMT2A (0.43) ALDH1A1LMNAMAPTPOLBCNR1
SCHEMBL14611804 0.81 KMT2A (0.38) ALDH1A1LMNAMAPTPOLBKMT2A
SCHEMBL14611646 0.81 KMT2A (0.34) ALDH1A1LMNAMAPTCNR2KMT2A
SCHEMBL12957467 0.80 POLB (0.46) ALDH1A1LMNAMAPTPOLBNPC1
SCHEMBL14611571 0.80 STAT3 (0.35) ALDH1A1LMNAMAPTCNR2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150174117-A1 4-OXOQUINOLINE COMPOUND AND USE THEREOF AS PHARMACEUTICAL AGENT JAPAN TOBACCO INC. 2015-06-25 — — US disclosed
US-20130172344-A1 4-OXOQUINOLINE COMPOUND AND USE THEREOF AS HIV INTEGRASE INHIBITOR JAPAN TOBACCO INC. 2013-07-04 — — US disclosed
US-7176220-B2 4-oxoquinoline compound and use thereof as pharmaceutical agent JAPAN TOBACCO INC. (JP) 2007-02-13 — — 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-20150174117-A1 4-OXOQUINOLINE COMPOUND AND USE THEREOF AS PHARMACEUTICAL AGENT IMPDH1, CDKL4, IMPDH2 ALDH1A1 712/4885LMNA 2369/4885MAPT 3144/4885
US-20130172344-A1 4-OXOQUINOLINE COMPOUND AND USE THEREOF AS HIV INTEGRASE INHIBITOR IMPDH1, CDKL4, IMPDH2 ALDH1A1 703/4885LMNA 2495/4885MAPT 3082/4885

“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.

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