SCHEMBL22040164

SCHEMBL22040164

c1cc2c(c(C3=NCCC3)c1)OCO2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.38
CHEK2 O96017 1/20 0.38
PKM P14618 1/20 0.37
TSHR P16473 1/20 0.37
RIPK3 Q9Y572 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
DHODH Q02127 1/20 0.36
CHRNB4 P30926 7/20 0.36
CHRNA3 P32297 7/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
THRB P10828 1/20 0.36
CYP2C19 P33261 1/20 0.36
EED O75530 1/20 0.34
PTGS2 P35354 1/20 0.33
NOS3 P29474 1/20 0.33
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33
TTBK1 Q5TCY1 1/20 0.33
TTBK2 Q6IQ55 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
SCHEMBL16309079 0.87 CHEK2 (0.38) CHEK2CHRNB4CHRNA3ALDH1A1CYP1A2
SCHEMBL7594061 0.76 ABCG2 (0.55) CHEK1CHEK2PKMTSHRRIPK3
SCHEMBL6198266 0.74 ABCG2 (0.43) CHEK1CHEK2PKMTSHRRIPK3
SCHEMBL10780010 0.70 NISCH (0.51)
SCHEMBL11390274 0.68 ABCG2 (0.50) CHEK1CHEK2PKMTSHRRIPK3
SCHEMBL4347210 0.68 RIPK3 (0.56) CHEK1CHEK2PKMTSHRRIPK3
SCHEMBL6312116 0.67 ABCG2 (0.48) CHEK1CHEK2PKMTSHRRIPK3
SCHEMBL3569157 0.67 NISCH (0.51) CHRNB4CHRNA3ALDH1A1PTGS2
SCHEMBL28799249 0.66 ABCG2 (0.46) CHEK1CHEK2PKMTSHRRIPK3
SCHEMBL30575803 0.66 ABCG2 (0.46) CHEK1CHEK2PKMTSHRRIPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3889138-B1 HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF HINOVA PHARMACEUTICALS INC (CN) 2024-11-20 EP disclosed
US-20220087996-A1 Histone acetylase p300 inhibitor and use thereof HINOVA PHARMACEUTICALS INC. (CN) 2022-03-24 US disclosed
US-20220087996-A1 Histone acetylase p300 inhibitor and use thereof HINOVA PHARMACEUTICALS INC. (CN) 2022-03-24 US disclosed
CN-111217802-B Histone acetylase p300 inhibitor and application thereof 海创药业股份有限公司 2021-10-08 CN disclosed
EP-3889138-A1 HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF Hinova Pharmaceuticals Inc. (CN) 2021-10-06 EP disclosed
WO-2020108500-A1 HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF 成都海创药业有限公司 2020-06-04 WO disclosed
CN-111217802-A Histone acetylase p300 inhibitor and application thereof 成都海创药业有限公司 2020-06-02 CN 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-20220087996-A1 Histone acetylase p300 inhibitor and use thereof EP300, HDAC1, HDAC11 CHEK1 1916/4885CHEK2 1562/4885PKM 3469/4885

“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.