SCHEMBL4354977

SCHEMBL4354977

CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](C(=O)O)C1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.60
BTK Q06187 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.49
ACACB O00763 7/20 0.44
ACACA Q13085 3/20 0.44
DRD2 P14416 2/20 0.44
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
EPHX1 P07099 1/20 0.40
ATM Q13315 1/20 0.40
CKS1B P61024 1/20 0.40
SKP1 P63208 1/20 0.40
SKP2 Q13309 1/20 0.40

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
SCHEMBL6641585 1.00 KMT2A (0.60) KMT2ABTKSMN1; SMN2ACACBACACA
SCHEMBL6641586 1.00 KMT2A (0.60) KMT2ABTKSMN1; SMN2ACACBACACA
SCHEMBL4346477 1.00 KMT2A (0.60) KMT2ABTKSMN1; SMN2ACACBACACA
SCHEMBL7246825 0.91 BTK (0.61) KMT2ABTKSMN1; SMN2ACACBACACA
SCHEMBL8141945 0.91 BTK (0.61) KMT2ABTKSMN1; SMN2ACACBACACA
SCHEMBL5262829 0.91 BTK (0.61) KMT2ABTKSMN1; SMN2ACACBACACA
SCHEMBL7680702 0.91 BTK (0.61) KMT2ABTKSMN1; SMN2ACACBACACA
SCHEMBL353652 0.91 KMT2A (0.71) KMT2ABTKSMN1; SMN2ACACBACACA
SCHEMBL353639 0.91 KMT2A (0.71) KMT2ABTKSMN1; SMN2ACACBACACA
SCHEMBL5006161 0.91 KMT2A (0.71) KMT2ABTKSMN1; SMN2ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230082167-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC (US) 2023-03-16 US disclosed
US-20180291029-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2018-10-11 US disclosed
US-20160326181-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2016-11-10 US disclosed
EP-3031324-A2 TRICYCLIC KINASE INHIBITORS AbbVie Inc. (US) 2016-06-15 EP disclosed
US-9365579-B2 Tricyclic compounds ABBVIE INC. (US) 2016-06-14 US disclosed
EP-2299821-B1 TRICYCLIC COMPOUNDS ABBVIE INC (US) 2015-11-04 EP disclosed
US-20150210708-A1 NOVEL TRICYCLIC COMPOUNDS ABBVIE INC. (US) 2015-07-30 US disclosed
US-8962629-B2 Tricyclic compounds ABBVIE INC. (US) 2015-02-24 US disclosed
US-20090312338-A1 Novel Tricyclic Compounds ABBOTT LABORATORIES (US) 2009-12-17 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-20180291029-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 KMT2A 3801/4885BTK 1260/4885SMN1; SMN2 3236/4885
US-20090312338-A1 Novel Tricyclic Compounds CYP11B2, CYP11B1, ABCB1 KMT2A 3801/4885BTK 1260/4885SMN1; SMN2 3236/4885
US-20160326181-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 KMT2A 3801/4885BTK 1260/4885SMN1; SMN2 3236/4885
US-20150210708-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 KMT2A 3801/4885BTK 1260/4885SMN1; SMN2 3236/4885
US-20230082167-A1 NOVEL TRICYCLIC COMPOUNDS CYP11B2, CYP11B1, ABCB1 KMT2A 3801/4885BTK 1260/4885SMN1; SMN2 3236/4885

“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.