SCHEMBL15914524

SCHEMBL15914524

O=C(Nc1nc2c(s1)CCCC2)c1cc(Cl)ccc1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 10/20 0.59
▸ MAPT P10636 10/20 0.59
▸ NPC1 O15118 10/20 0.55
▸ RAB9A P51151 10/20 0.55
▸ SMN1; SMN2 Q16637 8/20 0.55
▸ ALDH1A1 P00352 6/20 0.55
▸ PKM P14618 3/20 0.55
▸ HSD17B10 Q99714 3/20 0.55
▸ LMNA P02545 5/20 0.54
▸ NFKB1 P19838 5/20 0.54
▸ NFKB2 Q00653 5/20 0.54
▸ RELA Q04206 5/20 0.54
▸ MEN1 O00255 4/20 0.54
▸ KMT2A Q03164 4/20 0.54
▸ HPGD P15428 4/20 0.54
▸ NPSR1 Q6W5P4 2/20 0.54
▸ CASP3 P42574 1/20 0.54
▸ HTT P42858 1/20 0.54
▸ SENP8 Q96LD8 1/20 0.54
▸ SENP7 Q9BQF6 1/20 0.54

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
SCHEMBL3384688 0.84 MAPT (0.70) TP53MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL15916250 0.75 RAB9A (0.67) TP53MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL31622377 0.75 TP53 (0.56) TP53MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL17770342 0.73 DHODH (0.76) NPC1RAB9ASMN1; SMN2ALDH1A1PKM
SCHEMBL3109465 0.73 NPC1 (0.77) TP53MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL15401671 0.73 MAPT (0.64) TP53MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL30472740 0.72 KCNMA1 (0.64) MEN1KMT2AKCNMA1ALOX15
SCHEMBL14807083 0.71 RAB9A (0.75) TP53MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL14631274 0.71 MAPT (0.71) TP53MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL14654072 0.71 RAB9A (0.71) TP53MAPTNPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140221411-A1 2-HYDROXYARYLAMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER CONTAINING SAME AS ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2014-08-07 — — US claimed
US-9266872-B2 2-hydroxyarylamide derivative or pharmaceutically acceptable salt thereof, preparation method thereof, and pharmaceutical composition for preventing or treating cancer containing same as active ingredient KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2016-02-23 — — US disclosed
US-20140221411-A1 2-HYDROXYARYLAMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER CONTAINING SAME AS ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2014-08-07 — — US disclosed
US-20140221411-A1 2-HYDROXYARYLAMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER CONTAINING SAME AS ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2014-08-07 — — US disclosed
US-20140221411-A1 2-HYDROXYARYLAMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER CONTAINING SAME AS ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2014-08-07 — — 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 (1 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-20140221411-A1 2-HYDROXYARYLAMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER CONTAINING SAME AS ACTIVE INGREDIENT TMPRSS2, TMPRSS4, PRSS2 TP53 1111/4885MAPT 4549/4885NPC1 662/4885

“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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