SCHEMBL2197657

SCHEMBL2197657

CCCCCCC(N)(N)CN

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.50
FDPS P14324 2/20 0.50
DNM1 Q05193 8/20 0.46
TSHR P16473 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 1/20 0.46
EPHX1 P07099 1/20 0.46
THRB P10828 1/20 0.42
GGPS1 O95749 1/20 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
SCHEMBL11154564 1.00 SMPD1 (0.50) SMPD1FDPSDNM1TSHRMEN1
SCHEMBL28398962 1.00 SMPD1 (0.50) SMPD1FDPSDNM1TSHRMEN1
SCHEMBL8368601 0.97 FDPS (0.48) SMPD1FDPSDNM1TSHRMEN1
SCHEMBL22720561 0.89
Thiourea SCHEMBL10617827 0.89 SMPD1 (0.47) SMPD1FDPSDNM1TSHRMEN1
SCHEMBL49451 0.86 SMPD1 (0.50) SMPD1FDPSDNM1TSHRMEN1
SCHEMBL3889751 0.86 SMPD1 (0.50) SMPD1FDPSDNM1TSHRMEN1
SCHEMBL7708250 0.86 SMPD1 (0.50) SMPD1FDPSDNM1TSHRMEN1
SCHEMBL11518073 0.86 SMPD1 (0.50) SMPD1FDPSDNM1TSHRMEN1
SCHEMBL11405905 0.86 SMPD1 (0.50) SMPD1FDPSDNM1TSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1719794-B1 NOVEL POLYMERS AND USES THEREOF MITSUI CHEMICALS INC (JP) 2017-01-04 EP disclosed
US-7977429-B2 Polymers and uses thereof MITSUI CHEMICALS, INC. (JP) 2011-07-12 US disclosed
US-20070154431-A1 Novel polymers and uses thereof MITSUI CHEMICALS, INC. (JP) 2007-07-05 US disclosed
EP-1719794-A1 NOVEL POLYMERS AND USES THEREOF Mitsui Takeda Chemicals, Inc. (JP) 2006-11-08 EP 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-20070154431-A1 Novel polymers and uses thereof RAD54L, VCL, TYR SMPD1 3919/4885FDPS 4258/4885DNM1 3651/4885

“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.