SCHEMBL6396290

SCHEMBL6396290

BrCc1cccc(Cn2ccc3ccccc32)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.55
CDK4 P11802 4/20 0.50
CCND1 P24385 4/20 0.50
PLAU P00749 3/20 0.49
KMT2A Q03164 2/20 0.49
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
PLG P00747 1/20 0.46
POLB P06746 1/20 0.43
HTR2A P28223 1/20 0.41
HTR2C P28335 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
SCHEMBL30218821 0.84 HTR6 (0.55) HTR6CDK4CCND1PLAUKMT2A
SCHEMBL6086304 0.84 HTR6 (0.55) HTR6CDK4CCND1PLAUKMT2A
SCHEMBL29509279 0.81 HTR6 (0.73) HTR6CDK4CCND1PLAUKMT2A
SCHEMBL31021 0.81 HTR6 (0.73) HTR6CDK4CCND1PLAUKMT2A
SCHEMBL6085311 0.81 HTR6 (0.59) HTR6CDK4CCND1PLAUKMT2A
SCHEMBL8386546 0.81 HTR6 (0.55) HTR6CDK4CCND1PLAUKMT2A
SCHEMBL30218818 0.81 HTR6 (0.59) HTR6CDK4CCND1PLAUKMT2A
SCHEMBL1104768 0.81 HTR6 (0.55) HTR6CDK4CCND1PLAUKMT2A
SCHEMBL31258087 0.81 HTR6 (0.55) HTR6CDK4CCND1PLAUKMT2A
SCHEMBL2047825 0.81 HTR6 (0.69) HTR6CDK4CCND1PLAUKMT2A

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-20050054629-A1 Compounds and methods of treating cell proliferative diseases EXONHIT THERAPEUTICS SA (FR) 2005-03-10 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 (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-20050054629-A1 Compounds and methods of treating cell proliferative diseases MKI67, CCNC, PCNA HTR6 2401/4885CDK4 7/4885CCND1 51/4885

“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.