SCHEMBL20117644

SCHEMBL20117644

Oc1ccc(C(=S)Nc2cc(C(F)(F)F)ccc2N2CC[C@H]3CCCC[C@@H]3C2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
KDR P35968 1/20 0.42
SRPK2 P78362 1/20 0.42
SRPK1 Q96SB4 1/20 0.42
SRPK3 Q9UPE1 1/20 0.42
MAPT P10636 6/20 0.42
NPSR1 Q6W5P4 5/20 0.41
ALDH1A1 P00352 4/20 0.41
TSHR P16473 2/20 0.41
ALOX12 P18054 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CDK4 P11802 1/20 0.39
CDK9 P50750 1/20 0.39
KCNH2 Q12809 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38

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
SCHEMBL15849107 0.92 MAPT (0.44) LMNAKDRSRPK2SRPK1SRPK3
SCHEMBL1110657 0.90 SRPK1 (0.55) LMNAKDRSRPK2SRPK1SRPK3
SCHEMBL1110655 0.90 SRPK1 (0.55) LMNAKDRSRPK2SRPK1SRPK3
SCHEMBL1110656 0.90 SRPK1 (0.55) LMNAKDRSRPK2SRPK1SRPK3
SCHEMBL20117642 0.89 MEN1 (0.45) LMNAKDRSRPK2SRPK1SRPK3
SCHEMBL21322827 0.89 MEN1 (0.45) LMNAKDRSRPK2SRPK1SRPK3
SCHEMBL15277918 0.89 KDR (0.55) LMNAKDRSRPK2SRPK1SRPK3
SCHEMBL15277927 0.89 KDR (0.55) LMNAKDRSRPK2SRPK1SRPK3
SCHEMBL21322828 0.89 KDR (0.55) LMNAKDRSRPK2SRPK1SRPK3
SCHEMBL15277956 0.84 KDR (0.44) LMNAKDRSRPK2SRPK1SRPK3

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-20200188382-A1 PHARMACEUTICAL COMPOSITION FOR INDUCING PROGRAMMED CELL DEATH IN CANCER CELLS KYOTO UNIVERSITY (JP) 2020-06-18 US disclosed
WO-2018079855-A1 PHARMACEUTICAL COMPOSITION FOR INDUCING PROGRAMMED CELL DEATH IN CANCER CELLS 国立大学法人京都大学 2018-05-03 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-20200188382-A1 PHARMACEUTICAL COMPOSITION FOR INDUCING PROGRAMMED CELL DEATH IN CANCER CELLS CASP3, BAX, BAD LMNA 1177/4885KDR 3850/4885SRPK2 2165/4885

“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.