SCHEMBL26085552

SCHEMBL26085552

CC1CCn2cc(C(=O)O)cc2C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.47
KDM4E B2RXH2 2/20 0.44
GAA P10253 2/20 0.44
POLB P06746 1/20 0.44
NR4A1 P22736 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ACHE P22303 1/20 0.38
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
TP53 P04637 2/20 0.36
MITF O75030 1/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
DRD3 P35462 4/20 0.36
KMT2A Q03164 2/20 0.35
HTT P42858 1/20 0.35
ALDH1A1 P00352 4/20 0.35
HPGD P15428 2/20 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
SCHEMBL26085556 0.91 USP2 (0.42) USP2KDM4EGAAPOLBNR4A1
SCHEMBL26085553 0.83 ALDH1A1 (0.48) KDM4EHSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL21570140 0.82 HDAC6 (0.35) USP2KDM4EGAAPOLBNR4A1
SCHEMBL21570216 0.80 PTGER4 (0.36) KDM4EGAAPOLBNR4A1HSD17B10
SCHEMBL21570183 0.76 HDAC6 (0.36) USP2KDM4EGAAPOLBNR4A1
SCHEMBL21570180 0.75 KMT2A (0.36) KDM4EGAAPOLBNR4A1HSD17B10
SCHEMBL26085557 0.75 KDM4E (0.43) KDM4EHSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL21570231 0.72 ALDH1A1 (0.37) KDM4EGAAPOLBHSD17B10SMN1; SMN2
SCHEMBL4910441 0.70 USP2 (0.43) USP2KDM4EGAAPOLBNR4A1
SCHEMBL21576344 0.70 CA1 (0.32) KMT2A

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-20230312490-A1 MCL-1 INHIBITORS GILEAD SCIENCES, INC. 2023-10-05 US disclosed
US-11643400-B2 MCL-1 inhibitors GILEAD SCIENCES, INC. (US) 2023-05-09 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-20230312490-A1 MCL-1 INHIBITORS MCL1, BCL2L1, BCL2 USP2 893/4885KDM4E 2079/4885GAA 2577/4885
US-11643400-B2 MCL-1 inhibitors MCL1, BCL2L1, BCL2 USP2 893/4885KDM4E 2079/4885GAA 2577/4885

“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.