SCHEMBL30211329

SCHEMBL30211329

O=c1[nH]c2c(Br)cccc2c(=O)o1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.52
CFD P00746 1/20 0.52
ENPP3 O14638 1/20 0.45
ENPP1 P22413 1/20 0.45
KDM4E B2RXH2 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MCL1 Q07820 1/20 0.42
CA12 O43570 3/20 0.42
CA9 Q16790 3/20 0.42
PARP1 P09874 1/20 0.42
C1R P00736 2/20 0.41
KMT2A Q03164 1/20 0.41
CCNE2 O96020 1/20 0.41
CDK4 P11802 1/20 0.41
CCND1 P24385 1/20 0.41
CCNE1 P24864 1/20 0.41
CDK2 P24941 1/20 0.41
CAMK2B Q13554 1/20 0.41
CAMK2G Q13555 1/20 0.41
CAMK2D Q13557 1/20 0.41

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
SCHEMBL6739074 1.00 F2 (0.52) F2CFDENPP3ENPP1KDM4E
SCHEMBL21658311 0.81 F2 (0.55) F2CFDHSD17B10MCL1PARP1
SCHEMBL27469684 0.78 PARP1 (0.53) F2CFDKDM4EHSD17B10MCL1
SCHEMBL2060660 0.78 F2 (0.52) F2CFDKDM4EMCL1KMT2A
SCHEMBL1904323 0.78 F2 (0.52) F2CFDKDM4EHSD17B10MCL1
SCHEMBL28806284 0.78 F2 (0.43) F2CFDKDM4EMCL1C1R
SCHEMBL28715626 0.78 F2 (0.52) F2CFDMCL1CA12CA9
SCHEMBL2061364 0.78 F2 (0.52) F2CFDMCL1CA12CA9
SCHEMBL15211017 0.78 F2 (0.52) F2CFDKDM4EHSD17B10MCL1
SCHEMBL7503486 0.77 MCL1 (0.49) ENPP3ENPP1MCL1CA12CA9

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-11505545-B2 Anthelmintic quinoline-3-carboxamide derivatives BAYER ANIMAL HEALTH GMBH (DE) 2022-11-22 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-11505545-B2 Anthelmintic quinoline-3-carboxamide derivatives HRH4, HRH2, H1-5 F2 1284/4885CFD 3218/4885ENPP3 1652/4885

“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.