SCHEMBL19639670

SCHEMBL19639670

Cn1ccc2c(C(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)c[nH]c(=O)c21

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.45
▸ LMNA P02545 2/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ CRHBP P24387 1/20 0.45
▸ CRHR2 Q13324 1/20 0.45
▸ THRB P10828 1/20 0.45
▸ PARP1 P09874 1/20 0.45
▸ BRD4 O60885 1/20 0.44
▸ EPHX1 P07099 1/20 0.44
▸ ALPL P05186 1/20 0.43
▸ ALPI P09923 1/20 0.43
▸ ALPG P10696 1/20 0.43
▸ EPHX2 P34913 1/20 0.43
▸ BTK Q06187 1/20 0.43
▸ HDAC4 P56524 1/20 0.42

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
SCHEMBL19639682 0.86 KDM4E (0.55) LMNAMEN1KMT2AKDM4E
SCHEMBL4591737 0.78 EPHX2 (0.52) L3MBTL1POLBALDH1A1LMNAMEN1
SCHEMBL28579659 0.76 USP30 (0.52) L3MBTL1POLBALDH1A1LMNAMEN1
SCHEMBL23534299 0.73 L3MBTL1 (0.49) L3MBTL1POLBALDH1A1LMNAMEN1
SCHEMBL13503144 0.71 ALPL (0.51) L3MBTL1POLBALDH1A1LMNAMEN1
SCHEMBL22083658 0.71 USP30 (0.56) L3MBTL1POLBALDH1A1LMNAMEN1
SCHEMBL3963418 0.71 POLB (0.58) L3MBTL1POLBALDH1A1LMNAMEN1
SCHEMBL4960694 0.71 POLB (0.58) L3MBTL1POLBALDH1A1LMNAMEN1
SCHEMBL13906740 0.71 POLB (0.58) L3MBTL1POLBALDH1A1LMNAMEN1
SCHEMBL19639663 0.70 KDM4E (0.46) L3MBTL1ALDH1A1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10258603-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-04-16 — — US disclosed
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 — — 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 (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-10258603-B2 Therapeutic compounds and uses thereof BRD4, BRDT, BRD3 L3MBTL1 3326/4885POLB 1307/4885ALDH1A1 1563/4885
US-20170340604-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRD3 L3MBTL1 3326/4885POLB 1307/4885ALDH1A1 1563/4885

“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.

Send feedback