SCHEMBL16757679

SCHEMBL16757679

CC(=O)OCCn1c2ccc(C(=O)C(=NOC(C)=O)c3ccccc3C)cc2c2cc(C(=O)c3cccs3)ccc21

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.39
MAPT P10636 9/20 0.36
CTNNB1 P35222 1/20 0.35
WNT3A P56704 1/20 0.35
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
TSHR P16473 2/20 0.35
RAB9A P51151 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTT P42858 1/20 0.34
PTGS2 P35354 1/20 0.34
CNR2 P34972 2/20 0.33
NPC1 O15118 2/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
PTGER4 P35408 1/20 0.33

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
SCHEMBL16757677 1.00 PKM (0.39) PKMMAPTCTNNB1WNT3AALDH1A1
SCHEMBL16757721 0.94 PKM (0.38) PKMMAPTCTNNB1WNT3AALDH1A1
SCHEMBL16757718 0.94 PKM (0.38) PKMMAPTCTNNB1WNT3AALDH1A1
SCHEMBL18353743 0.92 PKM (0.35) PKMMAPTCTNNB1WNT3AALDH1A1
SCHEMBL17856966 0.91 PKM (0.40) PKMMAPTCTNNB1WNT3AALDH1A1
SCHEMBL18353747 0.91 PKM (0.40) PKMMAPTCTNNB1WNT3AALDH1A1
SCHEMBL18353984 0.90 CNR2 (0.45) PKMCNR2NPC1
SCHEMBL16773984 0.87 CNR2 (0.40) MAPTALDH1A1TSHRRAB9ACYP1A2
SCHEMBL18353986 0.86 HPGD (0.37) PKMMAPTALDH1A1SMN1; SMN2TSHR
SCHEMBL18353741 0.86 PKM (0.40) PKMMAPTALDH1A1SMN1; SMN2TSHR

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-20170003589-A1 PHOTOINITIATOR AND PHOTOSENSITIVE COMPOSITION INCLUDING THE SAME TAKOMA TECHNOLOGY CO., LTD (KR) 2017-01-05 US disclosed
EP-3057961-A1 PHOTOINITIATOR AND PHOTOSENSITIVE COMPOSITION INCLUDING THE SAME Takoma Technology Co., Ltd. (KR) 2016-08-24 EP disclosed
WO-2015080503-A1 PHOTOINITIATOR AND PHOTOSENSITIVE COMPOSITION INCLUDING THE SAME TAKOMA TECHNOLOGY CO., LTD. (KR) 2015-06-04 WO 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-20170003589-A1 PHOTOINITIATOR AND PHOTOSENSITIVE COMPOSITION INCLUDING THE SAME LCP1, ALAD, PITHD1 PKM 3038/4885MAPT 173/4885CTNNB1 2793/4885

“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.