SCHEMBL22700677

SCHEMBL22700677

Fc1ccc(N2CCCCCC2)c(NC(=S)c2ccncc2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 1/20 1.00
CDK9 P50750 1/20 1.00
KDR P35968 1/20 0.55
SRPK2 P78362 1/20 0.55
SRPK1 Q96SB4 1/20 0.55
SRPK3 Q9UPE1 1/20 0.55
MAPT P10636 5/20 0.49
KMT2A Q03164 4/20 0.46
MAPK1 P28482 3/20 0.46
ALDH1A1 P00352 9/20 0.45
RXFP1 Q9HBX9 1/20 0.45
NPSR1 Q6W5P4 5/20 0.45
GAA P10253 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
HTT P42858 3/20 0.45
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
POLB P06746 1/20 0.43
ERAP1 Q9NZ08 1/20 0.42
HPGD P15428 3/20 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
SCHEMBL29407903 1.00 CDK4 (1.00) CDK4CDK9KDRSRPK2SRPK1
SCHEMBL14803325 1.00 CDK4 (1.00) CDK4CDK9KDRSRPK2SRPK1
SCHEMBL29407904 1.00 CDK4 (1.00) CDK4CDK9KDRSRPK2SRPK1
SCHEMBL22700675 0.87 CDK4 (0.77) CDK4CDK9KDRSRPK2SRPK1
SCHEMBL16697768 0.86 CDK4 (0.75) CDK4CDK9KDRSRPK2SRPK1
SCHEMBL12855724 0.85 CDK4 (0.74) CDK4CDK9KDRSRPK2SRPK1
SCHEMBL23196029 0.85 CDK4 (0.74) CDK4CDK9KDRSRPK2SRPK1
SCHEMBL22700680 0.85 SRPK1 (0.74) CDK4CDK9KDRSRPK2SRPK1
SCHEMBL3485720 0.85 SRPK1 (0.74) CDK4CDK9KDRSRPK2SRPK1
SCHEMBL31187476 0.85 SRPK1 (0.74) CDK4CDK9KDRSRPK2SRPK1

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-20210100781-A1 TUMOR SUPPRESSION KYOTO UNIVERSITY (JP) 2021-04-08 US disclosed
WO-2020235672-A1 PHARMACEUTICAL COMPOSITION FOR ALZHEIMER'S DISEASE 国立大学法人京都大学 (JP) 2020-11-26 WO 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-20210100781-A1 TUMOR SUPPRESSION TSG101, TP53, VHL CDK4 2094/4885CDK9 3868/4885KDR 3702/4885

“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.