SCHEMBL21383987

SCHEMBL21383987

COC(=O)C1=NN(C)C(=O)C(C)C1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.33
GAA P10253 5/20 0.33
KMT2A Q03164 4/20 0.33
MEN1 O00255 2/20 0.33
KCNH2 Q12809 1/20 0.33
MAPT P10636 4/20 0.32
HPGD P15428 3/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 2/20 0.32
NPSR1 Q6W5P4 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
GPBAR1 Q8TDU6 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL21395225 0.84 TP53 (0.37) GAAKMT2AMEN1MAPT
SCHEMBL29356187 0.81 MAPT (0.33) MAPTHPGDPOLB
SCHEMBL29442778 0.70 RAB9A (0.47) GAAKMT2AMEN1MAPTHPGD
SCHEMBL21394579 0.69 PDE4D (0.50) GAAALDH1A1KDM4E
SCHEMBL16886895 0.66 POLB (0.37) GAAKMT2AMEN1HPGDALDH1A1
SCHEMBL19293602 0.63 NPC1 (0.48) GAAKMT2AMEN1MAPTALDH1A1
SCHEMBL10609396 0.62 NPSR1 (0.37) KMT2AMAPTNPSR1
SCHEMBL10609389 0.62 NPSR1 (0.37) KMT2AMAPTNPSR1
SCHEMBL17290974 0.62 SETD7 (0.44) GAAKMT2AMEN1MAPTHPGD
SCHEMBL17249868 0.61 NPSR1 (0.35) KMT2AMAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12180221-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-12-31 US disclosed
CN-118084800-A Compounds and uses thereof 詹森药业有限公司 2024-05-28 CN disclosed
CN-118084801-A Compounds and uses thereof 詹森药业有限公司 2024-05-28 CN disclosed
CN-112312913-B Compounds and uses thereof 詹森药业有限公司 2024-03-08 CN disclosed
US-20220298168-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2022-09-22 US disclosed
CN-114174273-A Compounds and uses thereof 优曼尼蒂治疗公司 2022-03-11 CN disclosed
EP-3941908-A1 COMPOUNDS AND USES THEREOF Yumanity Therapeutics, Inc. (US) 2022-01-26 EP disclosed
CN-112312913-A Compounds and uses thereof 优曼尼蒂治疗公司 2021-02-02 CN disclosed
EP-3768269-A1 COMPOUNDS AND USES THEREOF Yumanity Therapeutics, Inc. (US) 2021-01-27 EP disclosed
WO-2020198026-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-10-01 WO disclosed
WO-2020198026-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-10-01 WO disclosed
WO-2019183587-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2019-09-26 WO disclosed
WO-2019183587-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2019-09-26 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 (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-20220298168-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 BRD4 1356/4885GAA 67/4885KMT2A 2479/4885
US-12180221-B2 Compounds and uses thereof NLN, ACHE, CLN6 BRD4 1356/4885GAA 67/4885KMT2A 2479/4885

“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.