SCHEMBL22800985

SCHEMBL22800985

Cc1ccc(C)c(CCN2CCN(c3nc4c(c(=O)[nH]c(=O)n4C)n3Cc3ccccc3F)CC2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 4/20 0.63
▸ MAPT P10636 3/20 0.63
▸ GAA P10253 3/20 0.63
▸ HSD17B10 Q99714 2/20 0.63
▸ LMNA P02545 2/20 0.63
▸ NPSR1 Q6W5P4 2/20 0.63
▸ PKM P14618 1/20 0.59
▸ MEN1 O00255 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ USP2 O75604 3/20 0.55
▸ ALDH1A1 P00352 9/20 0.55
▸ TP53 P04637 3/20 0.55
▸ TSHR P16473 4/20 0.55
▸ HPGD P15428 1/20 0.55
▸ POLB P06746 2/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ GLA P06280 1/20 0.53
▸ MAPK1 P28482 2/20 0.51
▸ ALOX15 P16050 1/20 0.51
▸ SIRT5 Q9NXA8 1/20 0.51

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
SCHEMBL22800996 0.93 HTT (0.67) HTTMAPTGAAHSD17B10LMNA
SCHEMBL22800950 0.88 HTT (0.71) HTTMAPTGAAHSD17B10LMNA
SCHEMBL22800984 0.86 GAA (0.57) HTTMAPTGAAHSD17B10LMNA
SCHEMBL22800949 0.84 ALDH1A1 (0.57) HTTMAPTGAAHSD17B10LMNA
SCHEMBL22800926 0.84 GAA (0.58) HTTMAPTGAAHSD17B10LMNA
SCHEMBL22800923 0.84 PKM (0.66) HTTMAPTGAAHSD17B10LMNA
SCHEMBL22800958 0.83 USP2 (0.57) HTTMAPTGAAHSD17B10LMNA
SCHEMBL22800960 0.82 PKM (0.59) HTTMAPTGAAHSD17B10LMNA
SCHEMBL22800961 0.81 ALDH1A1 (0.66) HTTMAPTGAAHSD17B10LMNA
SCHEMBL22801000 0.81 USP2 (0.65) HTTMAPTHSD17B10LMNANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11578073-B2 Xanthine analogs as potent anti-West Nile viral agents SOUTHERN RESEARCH INSTITUTE (US) 2023-02-14 — — US disclosed
US-11578073-B2 Xanthine analogs as potent anti-West Nile viral agents SOUTHERN RESEARCH INSTITUTE (US) 2023-02-14 — — US disclosed
US-20200399271-A1 XANTHINE ANALOGS AS POTENT ANTI-WEST NILE VIRAL AGENTS OREGON HEALTH AND SCIENCE UNIVERSITY 2020-12-24 — — US disclosed
US-20200399271-A1 XANTHINE ANALOGS AS POTENT ANTI-WEST NILE VIRAL AGENTS OREGON HEALTH AND SCIENCE UNIVERSITY 2020-12-24 — — 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 (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-20200399271-A1 XANTHINE ANALOGS AS POTENT ANTI-WEST NILE VIRAL AGENTS XDH, PNP, MAVS HTT 2458/4885MAPT 872/4885GAA 281/4885
US-11578073-B2 Xanthine analogs as potent anti-West Nile viral agents XDH, PNP, MAVS HTT 2458/4885MAPT 872/4885GAA 281/4885

“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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