SCHEMBL20135180

SCHEMBL20135180

COCCC(=O)c1ccc(C)cc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.60
CTNNB1 P35222 3/20 0.57
WNT3A P56704 3/20 0.57
GSK3B P49841 1/20 0.53
MAPT P10636 3/20 0.53
NPC1 O15118 5/20 0.50
RAB9A P51151 5/20 0.50
MEN1 O00255 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
ALDH1A1 P00352 4/20 0.47
GAA P10253 1/20 0.47
LMNA P02545 1/20 0.46
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
ALOX12 P18054 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HDAC1 Q13547 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45

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
SCHEMBL17831000 0.87 KMT2A (0.55) KMT2ACTNNB1WNT3AGSK3BNPC1
SCHEMBL28394787 0.84 HSD17B3 (0.62) MAPTNPC1RAB9ATDP1ALDH1A1
SCHEMBL16998568 0.84 MAPT (0.53) KMT2AMAPTNPC1RAB9AALDH1A1
SCHEMBL16552778 0.83 KMT2A (0.83) KMT2ACTNNB1WNT3AGSK3BMAPT
SCHEMBL8864148 0.82 GSK3B (0.53) KMT2AGSK3BMAPTRAB9AMEN1
SCHEMBL12314004 0.82 MAPT (0.58) KMT2AMAPTNPC1RAB9AMEN1
SCHEMBL515747 0.82 MAPT (0.77) KMT2AGSK3BMAPTNPC1RAB9A
SCHEMBL1697056 0.82 MAPT (0.57) KMT2ACTNNB1WNT3AGSK3BMAPT
SCHEMBL19587028 0.81 RAB9A (0.60) KMT2ACTNNB1WNT3AGSK3BMAPT
SCHEMBL11506972 0.79 SMN1; SMN2 (0.66) KMT2AGSK3BMAPTNPC1RAB9A

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
CN-107922347-B Novel imide derivatives and their use as pharmaceuticals 田边三菱制药株式会社 2022-06-28 CN disclosed
US-10407408-B2 Imide derivatives and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-09-10 US disclosed
US-20190077787-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-03-14 US disclosed
EP-3321256-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2018-05-16 EP 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-20190077787-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE MMP9, MMP10, MMP1 KMT2A 2568/4885CTNNB1 3829/4885WNT3A 2065/4885
US-10407408-B2 Imide derivatives and use thereof as medicine MMP9, MMP2, MMP1 KMT2A 2539/4885CTNNB1 3993/4885WNT3A 2336/4885

“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.