SCHEMBL19728850

SCHEMBL19728850

CCCC(C)(C)CC(=O)N1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
ATM Q13315 1/20 0.42
POLB P06746 1/20 0.39
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
DPP4 P27487 1/20 0.37
HRH3 Q9Y5N1 1/20 0.36
HPGD P15428 1/20 0.36
GAA P10253 1/20 0.35

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
SCHEMBL24339478 0.98 L3MBTL1 (0.50) L3MBTL1MEN1KMT2ATDP1ATM
SCHEMBL21016157 0.85 GAA (0.40) L3MBTL1MEN1KMT2ATDP1HPGD
SCHEMBL12335994 0.84 L3MBTL1 (0.47) L3MBTL1MEN1KMT2ATDP1ATM
SCHEMBL19200319 0.84 TSHR (0.49) L3MBTL1POLBALDH1A1SMN1; SMN2HPGD
SCHEMBL12335991 0.82 L3MBTL1 (0.48) L3MBTL1MEN1KMT2ATDP1ATM
SCHEMBL19176972 0.80 L3MBTL1 (0.42) L3MBTL1MEN1KMT2ATDP1ATM
SCHEMBL19226236 0.78 KMT2A (0.45) L3MBTL1MEN1KMT2ATDP1ATM
SCHEMBL22292146 0.77 MEN1 (0.38) L3MBTL1MEN1KMT2ATDP1ATM
SCHEMBL803099 0.77 MEN1 (0.52) L3MBTL1MEN1KMT2ATDP1ATM
SCHEMBL12308800 0.76 ATM (0.41) L3MBTL1MEN1KMT2ATDP1ATM

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-20230277551-A1 ANTIBACTERIAL CHEMICAL COMPOUND, ITS MANUFACTURING METHOD AND ITS USE THEREOF NATIONAL YANG MING CHIAO TUNG UNIVERSITY (TW) 2023-09-07 US disclosed
US-10669252-B2 Benzazepine derivative, preparation method, pharmaceutical composition and use thereof Shanghai De Novo Pharmatech Co., Ltd. (CN) 2020-06-02 US disclosed
US-10301306-B2 Substituted dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-ones as RIPK3 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2019-05-28 US disclosed
US-20190152941-A1 BENZAZEPINE DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF Shanghai De Novo Pharmatech Co., Ltd. (CN) 2019-05-23 US disclosed
US-20170362219-A1 SUBSTITUTED DIHYDRO-1H-PYRROLO[3,2-C]PYRIDIN-4(5H)-ONES AS RIPK3 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-12-21 US 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 (5 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-20170362219-A1 SUBSTITUTED DIHYDRO-1H-PYRROLO[3,2-C]PYRIDIN-4(5H)-ONES AS RIPK3 INHIBITORS RIPK3, RIPK1, RIPK4 L3MBTL1 3918/4885MEN1 3949/4885KMT2A 3700/4885
US-10301306-B2 Substituted dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-ones as RIPK3 inhibitors RIPK3, RIPK1, RIPK4 L3MBTL1 3918/4885MEN1 3949/4885KMT2A 3700/4885
US-10669252-B2 Benzazepine derivative, preparation method, pharmaceutical composition and use thereof TLR8, TLR1, TLR5 L3MBTL1 3816/4885MEN1 2449/4885KMT2A 751/4885
US-20230277551-A1 ANTIBACTERIAL CHEMICAL COMPOUND, ITS MANUFACTURING METHOD AND ITS USE THEREOF VIP, MRPL21, GSDMD L3MBTL1 2327/4885MEN1 2902/4885KMT2A 3152/4885
US-20190152941-A1 BENZAZEPINE DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF TLR8, TLR1, TLR5 L3MBTL1 3816/4885MEN1 2449/4885KMT2A 751/4885

“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.