SCHEMBL21473969

SCHEMBL21473969

CCn1c(=O)cc(C(C)C)c2cc(N(C)C(=O)c3ccc(Cl)c(NCCCN(C)C)c3)ccc21

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.38
KDM4E B2RXH2 2/20 0.34
HPGD P15428 1/20 0.34
MAPT P10636 3/20 0.34
TP53 P04637 2/20 0.34
TOP2B Q02880 1/20 0.33
RORC P51449 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
BRD4 O60885 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
BRCA1 P38398 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
MAPK14 Q16539 1/20 0.30
CXCL8 P10145 1/20 0.30
THRB P10828 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
SCHEMBL20183695 0.85 TP53 (0.39) HPGDMAPTTP53LMNARXFP1
SCHEMBL20183556 0.82 RORC (0.38) KDM4EMAPTTP53RORCLMNA
SCHEMBL20183517 0.81 RXFP1 (0.40) KDM4EHPGDMAPTTP53RORC
SCHEMBL20183809 0.81 MAPT (0.40) KDM4EMAPTTP53RORCLMNA
SCHEMBL20183738 0.80 TP53 (0.35) KDM4EMAPTTP53RORCLMNA
SCHEMBL20183756 0.80 TP53 (0.38) HPGDMAPTTP53RORCLMNA
SCHEMBL20183774 0.80 RORC (0.36) KDM4EMAPTTP53RORCLMNA
SCHEMBL20183599 0.80 MAPT (0.35) KDM4EMAPTTP53RORCLMNA
SCHEMBL20183857 0.80 RXFP1 (0.40) MAPTTP53LMNARXFP1KMT2A
SCHEMBL20183650 0.79 ALDH1A1 (0.41) KDM4EHPGDMAPTTP53RORC

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-10987349-B2 Antitumor agent and bromodomain inhibitor FUJIFILM CORPORATION (JP) 2021-04-27 US disclosed
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR FUJIFILM CORPORATION (JP) 2019-10-17 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-10987349-B2 Antitumor agent and bromodomain inhibitor BRD4, BRD1, BRD3 DRD3 892/4885KDM4E 1027/4885HPGD 2185/4885
US-20190314360-A1 ANTITUMOR AGENT AND BROMODOMAIN INHIBITOR BRD4, BRD1, BRD3 DRD3 892/4885KDM4E 1027/4885HPGD 2185/4885

“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.