SCHEMBL19998404

SCHEMBL19998404

CC(C)c1cc(C(C)C)cc(P(C)c2cc(C(C)C)cc(C(C)C)c2)c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
FABP3 P05413 2/20 0.33
FABP4 P15090 2/20 0.33
FABP5 Q01469 1/20 0.32
LMNA P02545 1/20 0.31
TRPA1 O75762 1/20 0.30
PTGS1 P23219 1/20 0.30
CACNA1C Q13936 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
SCHEMBL338867 0.78 GABRA1 (0.46) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL1479773 0.76 FABP3 (0.37) GABRA1GABRB2FABP3FABP4FABP5
Calcium SCHEMBL29750665 0.75 GABRA1 (0.43) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL29415630 0.75 GABRA1 (0.43) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL28414081 0.75 GABRA1 (0.43) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL23202783 0.75 GABRA1 (0.43) GABRA1GABRB2FABP3FABP4FABP5
Hydrochloric Acid SCHEMBL5790729 0.75 GABRA1 (0.43) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL23202734 0.75 GABRA1 (0.43) GABRA1GABRB2FABP3FABP4FABP5
SCHEMBL3234036 0.75 GABRA1 (0.43) GABRA1GABRB2FABP3FABP4FABP5
Hydrogen Sulfide SCHEMBL28283354 0.75 GABRA1 (0.43) GABRA1GABRB2FABP3FABP4FABP5

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
US-10392451-B2 Ligand compound, organic chromium compound, catalyst system for olefin oligomerization, and method for oligomerizing olefins using the same thereof LG CHEM, LTD. (KR) 2019-08-27 US disclosed
US-20180086860-A1 LIGAND COMPOUND, ORGANIC CHROMIUM COMPOUND, CATALYST SYSTEM FOR OLEFIN OLIGOMERIZATION, AND METHOD FOR OLIGOMERIZING OLEFINS USING THE SAME LG CHEM, LTD. (KR) 2018-03-29 US disclosed
US-20180086860-A1 LIGAND COMPOUND, ORGANIC CHROMIUM COMPOUND, CATALYST SYSTEM FOR OLEFIN OLIGOMERIZATION, AND METHOD FOR OLIGOMERIZING OLEFINS USING THE SAME LG CHEM, LTD. (KR) 2018-03-29 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 (2 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-20180086860-A1 LIGAND COMPOUND, ORGANIC CHROMIUM COMPOUND, CATALYST SYSTEM FOR OLEFIN OLIGOMERIZATION, AND METHOD FOR OLIGOMERIZING OLEFINS USING THE SAME OXER1, OSTC, ORC3 GABRA1 2334/4885GABRB2 2803/4885FABP3 4134/4885
US-10392451-B2 Ligand compound, organic chromium compound, catalyst system for olefin oligomerization, and method for oligomerizing olefins using the same thereof OXER1, OSTC, ORC3 GABRA1 2248/4885GABRB2 2744/4885FABP3 4138/4885

“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.