SCHEMBL21874215

SCHEMBL21874215

COc1cccc(C2(C(=O)O)CCC(F)(F)CC2)c1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.49
▸ KMT2A Q03164 2/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.44
▸ OPRD1 P41143 2/20 0.43
▸ OPRM1 P35372 1/20 0.43
▸ OPRK1 P41145 1/20 0.43
▸ OPRL1 P41146 1/20 0.43
▸ HCAR2 Q8TDS4 1/20 0.43
▸ ELOVL1 Q9BW60 1/20 0.43
▸ AKR1C1 Q04828 1/20 0.42
▸ ADAM17 P78536 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL1465003 0.93 KMT2A (0.50) KDM1AKMT2AMEN1ALDH1A1OPRD1
SCHEMBL7467608 0.87 AKR1C1 (0.59) KMT2AMEN1ALDH1A1OPRD1OPRM1
SCHEMBL521247 0.87 AKR1C1 (0.54) KDM1AKMT2AMEN1ALDH1A1OPRD1
SCHEMBL8587542 0.85 AKR1C1 (0.57) KMT2AMEN1ALDH1A1OPRD1AKR1C1
SCHEMBL1626965 0.83 ICMT (0.48) KMT2AMEN1ALDH1A1OPRD1OPRM1
SCHEMBL4878231 0.83 HCAR2 (0.46) KDM1AKMT2AMEN1ALDH1A1OPRD1
SCHEMBL21874196 0.82 KMT2A (0.57) KMT2AMEN1ALDH1A1OPRM1OPRL1
SCHEMBL21873952 0.79 OPRM1 (0.57) KDM1AKMT2AMEN1ALDH1A1OPRD1
SCHEMBL3507379 0.79 LMNA (0.54) KDM1AKMT2AMEN1ALDH1A1OPRD1
SCHEMBL27736564 0.79 ADAM17 (0.56) KDM1AKMT2AMEN1ALDH1A1OPRD1

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-11274100-B2 EP300/CREBBP inhibitor DAIICHI SANKYO COMPANY, LIMITED (JP) 2022-03-15 — — US disclosed
US-20210171520-A1 EP300/CREBBP INHIBITOR DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-06-10 — — US disclosed
US-20210171520-A1 EP300/CREBBP INHIBITOR DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-06-10 — — US disclosed
EP-3643703-A1 EP300/CREBBP INHIBITOR Daiichi Sankyo Co., Ltd. (JP) 2020-04-29 — — EP disclosed
EP-3643703-A1 EP300/CREBBP INHIBITOR Daiichi Sankyo Co., Ltd. (JP) 2020-04-29 — — 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-11274100-B2 EP300/CREBBP inhibitor EP300, CREBBP, CREB1 KDM1A 216/4885KMT2A 124/4885MEN1 3511/4885
US-20210171520-A1 EP300/CREBBP INHIBITOR EP300, CREBBP, CREB1 KDM1A 216/4885KMT2A 124/4885MEN1 3511/4885

“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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