SCHEMBL14045083

SCHEMBL14045083

CCNC(=S)NC(=O)Cc1cccs1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
HPGD P15428 5/20 0.56
POLB P06746 2/20 0.53
KDM4E B2RXH2 5/20 0.53
LMNA P02545 4/20 0.53
GAA P10253 3/20 0.52
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
KMT2A Q03164 3/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
PKM P14618 2/20 0.50
MEN1 O00255 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
NPC1 O15118 1/20 0.50
TSHR P16473 1/20 0.50
HTT P42858 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50

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
SCHEMBL171960 0.85 ALDH1A1 (0.56) ALDH1A1HPGDPOLBKDM4ELMNA
SCHEMBL8319802 0.84 HPGD (0.72) ALDH1A1HPGDPOLBKDM4ERAB9A
SCHEMBL171966 0.81 PKM (0.57) ALDH1A1HPGDPOLBKDM4ELMNA
SCHEMBL14019914 0.81 ALDH1A1 (0.52) ALDH1A1HPGDPOLBKDM4ELMNA
SCHEMBL17993506 0.78 ALDH1A1 (0.58) ALDH1A1HPGDPOLBKDM4ELMNA
SCHEMBL12264637 0.77 HPGD (0.66) ALDH1A1HPGDPOLBKDM4ERAB9A
SCHEMBL18542949 0.75 ALDH1A1 (0.70) ALDH1A1HPGDPOLBKDM4ELMNA
SCHEMBL10172594 0.75 ALDH1A1 (0.58) ALDH1A1HPGDPOLBLMNAGAA
SCHEMBL15145919 0.75 KDM4E (0.73) ALDH1A1HPGDPOLBKDM4ELMNA
SCHEMBL5495002 0.74 HPGD (0.66) ALDH1A1HPGDPOLBKDM4ERAB9A

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-20080255155-A1 KINASE INHIBITORS AND USES THEREOF METHLYGENE INC. (CA) 2008-10-16 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-20080255155-A1 KINASE INHIBITORS AND USES THEREOF ABL1, MAP3K20, MAP3K1 ALDH1A1 3553/4885HPGD 2987/4885POLB 1862/4885

“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.