SCHEMBL20964666

SCHEMBL20964666

O=C(C1C=CC=C1)N1CCN(c2ccc(O)cc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.67
▸ MAPT P10636 5/20 0.51
▸ GAA P10253 3/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ LMNA P02545 2/20 0.51
▸ ME2 P23368 7/20 0.49
▸ ME1 P48163 7/20 0.49
▸ ME3 Q16798 7/20 0.49
▸ ALDH1A1 P00352 3/20 0.47
▸ PKM P14618 1/20 0.47
▸ CA12 O43570 3/20 0.47
▸ CA2 P00918 3/20 0.47
▸ CA9 Q16790 3/20 0.47
▸ CA1 P00915 2/20 0.47
▸ USP2 O75604 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ MEN1 O00255 2/20 0.46

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
SCHEMBL20964570 0.86 MEN1 (0.62) MAPTLMNAME2ME1ME3
SCHEMBL20965418 0.82 DRD2 (0.47) TDP1MAPTGAALMNAALDH1A1
SCHEMBL27936730 0.77 TDP1 (0.66) TDP1MAPTGAAKDM4ELMNA
SCHEMBL20964685 0.76 HTR1A (0.62) MAPTLMNAALDH1A1CA12CA9
SCHEMBL3466014 0.75 TDP1 (0.64) TDP1MAPTGAAKDM4ELMNA
SCHEMBL20964593 0.75 KMT2A (0.55) MAPTGAALMNAALDH1A1ALOX15
SCHEMBL20964530 0.75 ALDH1A1 (0.53) MAPTGAALMNAALDH1A1CA12
SCHEMBL7041242 0.74 MAPT (0.68) TDP1MAPTGAAKDM4ELMNA
SCHEMBL19059406 0.74 TDP1 (0.62) TDP1MAPTGAAKDM4ELMNA
SCHEMBL1128293 0.74 GFER (0.71) TDP1MAPTGAAKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10851096-B2 Aryl and heteroaryl amides for use as anti-proliferative, anti-thrombotic, and anti-viral agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2020-12-01 — — US disclosed
US-20190127361-A1 Therapeutic Compounds RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2019-05-02 — — 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-20190127361-A1 Therapeutic Compounds SDHA, SLC10A1, SERPINC1 TDP1 3109/4885MAPT 1626/4885GAA 57/4885
US-10851096-B2 Aryl and heteroaryl amides for use as anti-proliferative, anti-thrombotic, and anti-viral agents SERPINC1, F12, RPL35 TDP1 1435/4885MAPT 4673/4885GAA 288/4885

“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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