SCHEMBL982283

SCHEMBL982283

CCCCc1c(Oc2ccccc2)[c]ccc1CCC

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.41
MAPT P10636 3/20 0.32
HTT P42858 2/20 0.32
POLB P06746 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HDAC3 O15379 1/20 0.32
LMNA P02545 1/20 0.32
BCL2L2 Q92843 1/20 0.31

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
SCHEMBL980128 0.96 LTA4H (0.42) LTA4H
SCHEMBL984698 0.96 LTA4H (0.42) LTA4HMAPTHTTPOLBATM
SCHEMBL981201 0.93 LTA4H (0.38) LTA4HMAPTALDH1A1GAABCL2L2
SCHEMBL982031 0.91 LTA4H (0.41) LTA4HMAPTPOLBATML3MBTL1
SCHEMBL983303 0.87 LTA4H (0.42) LTA4HPOLBATML3MBTL1HDAC3
SCHEMBL981916 0.85 LTA4H (0.37) LTA4HHTTALDH1A1GAALMNA
SCHEMBL982120 0.85 LTA4H (0.44) LTA4HMAPTHTTPOLBATM
SCHEMBL984172 0.81 LTA4H (0.44) LTA4HMAPTHTTPOLBATM
SCHEMBL983863 0.81 LTA4H (0.38) LTA4HMAPTALDH1A1GAA
SCHEMBL983439 0.78 LTA4H (0.45) LTA4HMAPTHTTPOLBATM

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-2275406-B1 PROCESS FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2018-11-28 EP disclosed
US-9233918-B2 Isocyanate production process ASAHI KASEI CHEMICALS CORPORATION (JP) 2016-01-12 US disclosed
US-20110092731-A1 ISOCYANATE PRODUCTION PROCESS ASAHI KASEI CHEMICALS CORPORATION (JP) 2011-04-21 US disclosed
EP-2275406-A1 PROCESS FOR PRODUCING ISOCYANATE Asahi Kasei Chemicals Corporation (JP) 2011-01-19 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-20110092731-A1 ISOCYANATE PRODUCTION PROCESS CPS1, PHGDH, APEH LTA4H 1039/4885MAPT 2985/4885HTT 2433/4885

“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.