SCHEMBL6645183

SCHEMBL6645183

CC(NC(=O)OC(C)(C)C)C1CCC(C(=O)O)CC1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.58
BTK Q06187 1/20 0.47
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CTSS P25774 5/20 0.40
CTSK P43235 5/20 0.40
EPHX2 P34913 1/20 0.38
CYP2D6 P10635 1/20 0.37
AAK1 Q2M2I8 1/20 0.37
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
PREP P48147 1/20 0.36
ATM Q13315 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ELANE P08246 1/20 0.36

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
SCHEMBL16755143 1.00 KMT2A (0.58) KMT2ABTKCA1CA2CA7
SCHEMBL23611929 1.00 KMT2A (0.58) KMT2ABTKCA1CA2CA7
SCHEMBL16755142 1.00 KMT2A (0.58) KMT2ABTKCA1CA2CA7
SCHEMBL16732777 1.00 KMT2A (0.58) KMT2ABTKCA1CA2CA7
SCHEMBL25281173 0.90 CA1 (0.47) KMT2ABTKCA1CA2CA7
SCHEMBL24439605 0.90 CA1 (0.47) KMT2ABTKCA1CA2CA7
SCHEMBL23624647 0.86 KMT2A (0.44) KMT2ABTKCA1CA2CA7
SCHEMBL23611982 0.86 KMT2A (0.44) KMT2ABTKCA1CA2CA7
SCHEMBL23624897 0.86 KMT2A (0.44) KMT2ABTKCA1CA2CA7
SCHEMBL23625138 0.86 KMT2A (0.44) KMT2ABTKCA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12473284-B2 Small molecule inhibitors of ULK1 MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2025-11-18 US disclosed
US-20230117572-A1 SMALL MOLECULE INHIBITORS OF ULK1 MEMORIAL SLOAN KETTERING CANCER CENTER 2023-04-20 US disclosed
WO-2021138331-A2 SMALL MOLECULE INHIBITORS OF ULK1 MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2021-07-08 WO disclosed
WO-2021138331-A2 SMALL MOLECULE INHIBITORS OF ULK1 MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2021-07-08 WO disclosed
US-9758480-B2 1-(cycloalkyl-carbonyl)proline derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2017-09-12 US disclosed
US-20150210640-A1 1-(CYCLOALKYL-CARBONYL)PROLINE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2015-07-30 US disclosed
EP-2876105-A1 1-(CYCLOALKYL-CARBONYL)PROLINE DERIVATIVE Sumitomo Dainippon Pharma Co., Ltd. (JP) 2015-05-27 EP disclosed
EP-1299362-A4 SELECTIVE MELANIN CONCENTRATING HORMONE-1 (MCH1) RECEPTOR ANTAGONISTS AND USES THEREOF SYNAPTIC PHARMA CORP (US) 2004-11-03 EP disclosed
EP-1299362-A1 SELECTIVE MELANIN CONCENTRATING HORMONE-1 (MCH1) RECEPTOR ANTAGONISTS AND USES THEREOF Synaptic Pharmaceutical Corporation (US) 2003-04-09 EP disclosed
WO-2002006245-A1 SELECTIVE MELANIN CONCENTRATING HORMONE-1 (MCH1) RECEPTOR ANTAGONISTS AND USES THEREOF SYNAPTIC PHARMARCEUTICAL CORPORATION (US) 2002-01-24 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 (3 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-20230117572-A1 SMALL MOLECULE INHIBITORS OF ULK1 ULK1, ULK2, ULK3 KMT2A 2653/4885BTK 1090/4885CA1 4704/4885
US-12473284-B2 Small molecule inhibitors of ULK1 ULK1, ULK2, ULK3 KMT2A 2653/4885BTK 1090/4885CA1 4704/4885
US-20150210640-A1 1-(CYCLOALKYL-CARBONYL)PROLINE DERIVATIVE RB1, F2, SFPQ KMT2A 484/4885BTK 305/4885CA1 2538/4885

“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.