SCHEMBL18969221

SCHEMBL18969221

C=C1CCc2c1ccc1c2c2cc(C(C)=O)c(O)cc2n1CCCC(C)C

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.40
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
WEE1 P30291 6/20 0.31
CHEK1 O14757 1/20 0.31
KDR P35968 1/20 0.30
TEK Q02763 1/20 0.30

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
SCHEMBL18975969 0.90 TP53 (0.49) TP53LMNAGAAWEE1CHEK1
SCHEMBL18328995 0.87 TP53 (0.40) TP53LMNAGAAWEE1CHEK1
SCHEMBL12608686 0.86 WEE1 (0.44) TP53WEE1CHEK1
SCHEMBL15848976 0.86 TP53 (0.39) TP53WEE1
SCHEMBL15848980 0.81 TP53 (0.63) TP53
SCHEMBL2361050 0.77 TP53 (0.47) TP53WEE1CHEK1
SCHEMBL16131566 0.77 TP53 (0.51) TP53LMNAWEE1CHEK1KDR
SCHEMBL12608670 0.76 WEE1 (0.41) TP53WEE1CHEK1KDR
SCHEMBL13418915 0.76 TP53 (0.49) TP53WEE1KDRTEK
SCHEMBL18329003 0.76 TP53 (0.40) TP53LMNAKDRTEK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170165229-A1 CARBAZOLE COMPOUNDS AND THERAPEUTIC USES OF THE COMPOUNDS INCURON, INC. 2017-06-15 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 (1 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-20170165229-A1 CARBAZOLE COMPOUNDS AND THERAPEUTIC USES OF THE COMPOUNDS MALT1, PAICS, BCL9 TP53 28/4885LMNA 4194/4885GAA 474/4885

“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.