SCHEMBL22030873

SCHEMBL22030873

CN(CC(=O)N1CCCC1)C1CCN(C(=O)CC(C)(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.41
KMT2A Q03164 4/20 0.37
MEN1 O00255 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
DPP4 P27487 2/20 0.36
FAAH O00519 1/20 0.36
ALDH1A1 P00352 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
CCR5 P51681 1/20 0.35
ATM Q13315 2/20 0.35
TACR1 P25103 1/20 0.34

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
SCHEMBL22030876 0.85 CYP3A4 (0.41) CYP3A4KMT2AMEN1DPP4FAAH
SCHEMBL18909244 0.83 EPHX2 (0.49) KMT2AMEN1ALDH1A1SMN1; SMN2ATM
SCHEMBL22030495 0.83 NPC1 (0.41) CYP3A4KMT2AMEN1DPP4FAAH
SCHEMBL19444608 0.82 KMT2A (0.47) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL19444620 0.82 KMT2A (0.47) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL24521422 0.82 CPN1 (0.40) KMT2AMEN1DPP4ALDH1A1SMN1; SMN2
SCHEMBL21281128 0.80 EPHX2 (0.49) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL30098883 0.80 LMNA (0.41) KMT2AMEN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL24521472 0.79 KMT2A (0.40) KMT2AMEN1DPP4ALDH1A1SMN1; SMN2
SCHEMBL24244796 0.79 CPN1 (0.40) KMT2AMEN1DPP4ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11795170-B2 Therapeutic compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2023-10-24 US disclosed
US-11795170-B2 Therapeutic compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2023-10-24 US disclosed
US-11649241-B2 Pyrazolochlorophenyl compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2023-05-16 US disclosed
US-20220204517-A1 INHALED POWDER FORMULATIONS GENENTECH, INC. (US) 2022-06-30 US disclosed
US-20210009599-A1 THERAPEUTIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-01-14 US disclosed
US-20200165260-A1 INHALED POWDER FORMULATIONS GENENTECH, INC. (US) 2020-05-28 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-11795170-B2 Therapeutic compounds, compositions and methods of use thereof JAK2, JAK1, JAK3 CYP3A4 2930/4885KMT2A 2305/4885MEN1 983/4885
US-20200165260-A1 INHALED POWDER FORMULATIONS JAK1, STAT5A, JAK2 CYP3A4 2135/4885KMT2A 947/4885MEN1 2687/4885
US-11649241-B2 Pyrazolochlorophenyl compounds, compositions and methods of use thereof JAK1, JAK2, JAK3 CYP3A4 380/4885KMT2A 1835/4885MEN1 1241/4885
US-20220204517-A1 INHALED POWDER FORMULATIONS JAK1, STAT5A, JAK2 CYP3A4 2135/4885KMT2A 947/4885MEN1 2687/4885
US-20210009599-A1 THERAPEUTIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF JAK2, JAK1, JAK3 CYP3A4 2930/4885KMT2A 2305/4885MEN1 983/4885

“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.