SCHEMBL887388

SCHEMBL887388

C=CCOP1(=O)Nc2ccc3ccccc3c2-c2c(ccc3ccccc23)N1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.36
GAA P10253 2/20 0.36
POLB P06746 1/20 0.36
GPR84 Q9NQS5 1/20 0.34
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA9 Q16790 2/20 0.33
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
WDR5 P61964 1/20 0.31
LMNA P02545 1/20 0.31
GFER P55789 1/20 0.31
DNMT1 P26358 1/20 0.30
CYP3A4 P08684 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL887397 0.76 ALDH1A1 (0.40) CA12CA1CA9CYP3A4MEN1
SCHEMBL887390 0.73 HKDC1 (0.31) HPGDGAAKDM4ELMNA
SCHEMBL887292 0.71 GPR84 (0.50) GPR84KDM4EMAPTWDR5DNMT1
SCHEMBL887355 0.65 GPR84 (0.43) HPGDGAAPOLBGPR84KDM4E
SCHEMBL887284 0.63 GPR84 (0.65) HPGDGPR84KDM4EWDR5MEN1
SCHEMBL20554922 0.61 HPGD (0.48) HPGDGAAPOLBCA12CA1
SCHEMBL2523778 0.60 HPGD (0.56) HPGDGAAPOLBKDM4E
SCHEMBL4265934 0.60 CYP3A4 (0.40) HPGDCA12CA1CA9KDM4E
SCHEMBL4266742 0.59 HPGD (0.68) HPGDGAAPOLBCA12CA1
SCHEMBL4371294 0.59 HPGD (0.56) HPGDCA12CA1CA9KDM4E

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
US-7902207-B2 Process for production of amines TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-03-08 US disclosed
US-7902207-B2 Process for production of amines TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-03-08 US disclosed
US-20070142639-A1 Process for production of amines TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-06-21 US disclosed
US-20070142639-A1 Process for production of amines TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-06-21 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-20070142639-A1 Process for production of amines SMS, CCNT1, PEAK1 HPGD 2901/4885GAA 2259/4885POLB 1230/4885

“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.