SCHEMBL17483155

SCHEMBL17483155

CCOC(=O)Cn1c2ccccc2c2cc(/C=C/C#N)ccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.61
▸ KDM4E B2RXH2 6/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ DHODH Q02127 1/20 0.50
▸ MAPT P10636 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ ALDH1A1 P00352 5/20 0.48
▸ TSHR P16473 2/20 0.47
▸ HPGD P15428 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ SAE1 Q9UBE0 1/20 0.47
▸ UBA2 Q9UBT2 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ HTT P42858 2/20 0.46
▸ CTNNB1 P35222 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ PKM P14618 1/20 0.44

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
SCHEMBL17483160 0.85 KDM4E (0.57) KDM4EMAPTL3MBTL1MAPK1ALDH1A1
SCHEMBL1102250 0.85 KDM4E (0.57) KDM4EMAPTL3MBTL1MAPK1ALDH1A1
SCHEMBL29002814 0.83 KDM4E (0.63) TDP1KDM4ERAB9AMAPTL3MBTL1
SCHEMBL29540705 0.80 KDM4E (0.71) TDP1KDM4ERAB9AMAPTL3MBTL1
SCHEMBL151122 0.80 KDM4E (0.71) TDP1KDM4ERAB9AMAPTL3MBTL1
SCHEMBL28098262 0.78 RORA (0.50) KDM4EALDH1A1HTTPOLBPKM
SCHEMBL29002887 0.76 KDM4E (0.63) TDP1KDM4ERAB9AL3MBTL1ALDH1A1
SCHEMBL29351992 0.76 SMN1; SMN2 (0.43) KDM4ERAB9ADHODHMAPTALDH1A1
SCHEMBL17483153 0.76 SMN1; SMN2 (0.43) KDM4ERAB9ADHODHMAPTALDH1A1
SCHEMBL23845876 0.75 GPR3 (0.48) TDP1KDM4ERAB9AMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10844087-B2 Method of suppressing formation of photocrosslink, and photoreactive nucleic acid in which auto-crosslink formation is suppressed JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2020-11-24 — — US disclosed
US-10450334-B2 Photoresponsive nucleotide analogue having photocrosslinking ability JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2019-10-22 — — US disclosed
US-20160326207-A1 METHOD OF SUPPRESSING FORMATION OF PHOTOCROSSLINK, AND PHOTOREACTIVE NUCLEIC ACID IN WHICH AUTO-CROSSLINK FORMATION IS SUPPRESSED JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2016-11-10 — — US disclosed
US-20160326207-A1 METHOD OF SUPPRESSING FORMATION OF PHOTOCROSSLINK, AND PHOTOREACTIVE NUCLEIC ACID IN WHICH AUTO-CROSSLINK FORMATION IS SUPPRESSED JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2016-11-10 — — US disclosed
US-20160031918-A1 PHOTORESPONSIVE NUCLEOTIDE ANALOGUE HAVING PHOTOCROSSLINKING ABILITY JAPAN ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2016-02-04 — — US disclosed
US-20160031918-A1 PHOTORESPONSIVE NUCLEOTIDE ANALOGUE HAVING PHOTOCROSSLINKING ABILITY JAPAN ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) 2016-02-04 — — 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-10450334-B2 Photoresponsive nucleotide analogue having photocrosslinking ability PCNA, DPYD, NUDT1 TDP1 150/4885KDM4E 3068/4885RAB9A 2289/4885
US-20160326207-A1 METHOD OF SUPPRESSING FORMATION OF PHOTOCROSSLINK, AND PHOTOREACTIVE NUCLEIC ACID IN WHICH AUTO-CROSSLINK FORMATION IS SUPPRESSED PCNA, POLL, LIG1 TDP1 182/4885KDM4E 4084/4885RAB9A 3980/4885
US-10844087-B2 Method of suppressing formation of photocrosslink, and photoreactive nucleic acid in which auto-crosslink formation is suppressed UPP1, UNG, PCNA TDP1 57/4885KDM4E 4000/4885RAB9A 4003/4885
US-20160031918-A1 PHOTORESPONSIVE NUCLEOTIDE ANALOGUE HAVING PHOTOCROSSLINKING ABILITY PCNA, DPYD, NUDT1 TDP1 150/4885KDM4E 3068/4885RAB9A 2289/4885

“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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