SCHEMBL12374749

SCHEMBL12374749

C/C=C/CONc1ccncc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.37
BCHE P06276 2/20 0.33
MDM2 Q00987 1/20 0.31
GAA P10253 1/20 0.31
RAB9A P51151 1/20 0.31
POLB P06746 1/20 0.31
NOD2 Q9HC29 1/20 0.31
RAD52 P43351 1/20 0.31
LMNA P02545 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
PKM P14618 1/20 0.30
KMT2A Q03164 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC4 P56524 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC7 Q8WUI4 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC10 Q969S8 1/20 0.30
HDAC11 Q96DB2 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
SCHEMBL9090785 0.81 TSHR (0.34) CTSDALDH1A1
SCHEMBL11318079 0.81 TSHR (0.34) CTSDALDH1A1
Oxalic Acid SCHEMBL9722961 0.74 ALOX5 (0.37) GAALMNAALDH1A1
SCHEMBL9174077 0.71 CTSD (0.41) CTSDBCHEMDM2RAB9APOLB
SCHEMBL20113017 0.71 CTSD (0.41) CTSDBCHEMDM2RAB9APOLB
SCHEMBL14908516 0.66
SCHEMBL12198931 0.65 CTSD (0.48) CTSDMDM2GAARAB9ARAD52
SCHEMBL151828 0.63 LOXL2 (0.48) LMNAMEN1ALDH1A1KMT2A
SCHEMBL28313469 0.61 CTSD (0.44) CTSDBCHEMDM2GAAPOLB
SCHEMBL6202987 0.61

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989478-B2 decreases expression of a Type I collage gene in a tissue to induce a reduction in accumulation of collagen and thereby improves tissue fibrosis SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-02 US disclosed
US-7691883-B2 Cinnamoyl compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-06 US disclosed
US-20100081652-A1 Cinnamoyl Compound and Use Thereof SHIRAKI HIROAKI 2010-04-01 US disclosed
US-20090143368-A1 Use of Cinnamoyl Compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-04 US disclosed
US-20070265228-A1 Cinnamoyl compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-11-15 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 (3 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-20100081652-A1 Cinnamoyl Compound and Use Thereof COL2A1, MMP7, COL14A1 CTSD 731/4885BCHE 4099/4885MDM2 2406/4885
US-20070265228-A1 Cinnamoyl compound and use of the same NPC1, CES2, CYP51A1 CTSD 476/4885BCHE 943/4885MDM2 2771/4885
US-20090143368-A1 Use of Cinnamoyl Compound COL2A1, COL1A1, SMAD2 CTSD 1199/4885BCHE 4764/4885MDM2 2586/4885

“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.