SCHEMBL23482191

SCHEMBL23482191

Cc1ccc2c(c1)N(C(C)C)C(=O)CC2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
BRD4 O60885 2/20 0.43
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SRD5A1 P18405 3/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
MAPT P10636 2/20 0.39
AADAT Q8N5Z0 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2B Q13224 1/20 0.38
TP53 P04637 2/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
PARP1 P09874 1/20 0.36
PARP10 Q53GL7 1/20 0.36
HDAC1 Q13547 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
TSHR P16473 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
SCHEMBL5541492 0.87 SRD5A1 (0.47) ALDH1A1HSD17B10SMN1; SMN2SRD5A1CYP2D6
SCHEMBL20353827 0.85 HSD17B10 (0.43) ALDH1A1HSD17B10L3MBTL1SMN1; SMN2CYP2D6
SCHEMBL15625443 0.82 BRD4 (0.42) ALDH1A1BRD4HSD17B10L3MBTL1SMN1; SMN2
SCHEMBL24359222 0.82 SRD5A1 (0.41) BRD4SMN1; SMN2SRD5A1CYP2D6CYP2C9
SCHEMBL30926398 0.82 CYP2D6 (0.46) BRD4L3MBTL1SMN1; SMN2SRD5A1CYP2D6
SCHEMBL20942631 0.80 SRD5A1 (0.40) ALDH1A1BRD4L3MBTL1SMN1; SMN2SRD5A1
SCHEMBL5956393 0.77 SMN1; SMN2 (0.55) BRD4HSD17B10L3MBTL1SMN1; SMN2SRD5A1
SCHEMBL29896794 0.77 SMN1; SMN2 (0.55) BRD4HSD17B10L3MBTL1SMN1; SMN2SRD5A1
SCHEMBL5023390 0.77 SRD5A1 (0.54) ALDH1A1BRD4HSD17B10L3MBTL1SRD5A1
SCHEMBL24123320 0.76 ALDH1A1 (0.45) ALDH1A1HSD17B10L3MBTL1SRD5A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11358936-B2 Lysyl oxidase-like 2 inhibitors and uses thereof PHARMAKEA, INC. (US) 2022-06-14 US disclosed
US-11072585-B2 Fluorinated lysyl oxidase-like 2 inhibitors and uses thereof PHARMAKEA, INC. (US) 2021-07-27 US disclosed
US-20210171465-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA INC (US) 2021-06-10 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 (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-11358936-B2 Lysyl oxidase-like 2 inhibitors and uses thereof LOXL2, LOXL1, LOX ALDH1A1 982/4885BRD4 2041/4885HSD17B10 584/4885
US-20210171465-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF LOXL2, LOXL1, LOX ALDH1A1 982/4885BRD4 2041/4885HSD17B10 584/4885
US-11072585-B2 Fluorinated lysyl oxidase-like 2 inhibitors and uses thereof LOXL2, LOXL1, LOX ALDH1A1 1095/4885BRD4 2093/4885HSD17B10 756/4885

“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.