SCHEMBL10013355

SCHEMBL10013355

C=C(CCC1CO1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.41
MAOB P27338 4/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HTT P42858 1/20 0.39
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 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
SCHEMBL11705308 0.83 MAOA (0.40) MAOAMAOBHTTSLC6A4SLC6A3
SCHEMBL2042739 0.82 MAOA (0.42) MAOAMAOBTDP1
SCHEMBL1499224 0.79 MAPT (0.52) MEN1KMT2ATDP1HTT
Benzophenone SCHEMBL3179837 0.79 ALDH1A1 (0.42) MEN1KMT2ATDP1HTT
SCHEMBL11702308 0.77 L3MBTL1 (0.44) MAOAMAOBMEN1KMT2ASLC6A4
SCHEMBL7990104 0.76 MAOA (0.56) MAOAMAOBMEN1KMT2ATDP1
SCHEMBL817735 0.76 MAOA (0.40) MAOAMAOBKMT2AHTTSLC6A4
SCHEMBL13371522 0.75 MEN1 (0.46) MEN1KMT2ASLC6A4SLC6A3
SCHEMBL7531296 0.75 TDP1 (0.47) MAOAMAOBMEN1KMT2ATDP1
SCHEMBL1536703 0.74 MAOA (0.56) MAOAMAOBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104203989-B Polymerization comprises the compositions of farnesene 阿迈瑞斯公司 2016-10-12 CN disclosed
CN-104203989-A Polymerization of compositions comprising a farnesene AMYRIS INC 2014-12-10 CN disclosed
US-20120029241-A1 METHOD FOR PRODUCING CARBONYL COMPOUND, CATALYST, AND METHOD FOR PRODUCING CATALYST THE UNIVERSITY OF TOKYO (JP) 2012-02-02 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-20120029241-A1 METHOD FOR PRODUCING CARBONYL COMPOUND, CATALYST, AND METHOD FOR PRODUCING CATALYST PCCA, PPOX, COASY MAOA 927/4885MAOB 712/4885MEN1 3360/4885

“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.