SCHEMBL1950967

SCHEMBL1950967

Cc1cc(C)c([N+]2=CN(C3CCCCC3)CC2)c(C)c1.F[B-](F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ EBP Q15125 1/20 0.32
▸ DHCR7 Q9UBM7 1/20 0.32
▸ EPHX2 P34913 5/20 0.32
▸ TAS1R3 Q7RTX0 2/20 0.30
▸ TAS1R1 Q7RTX1 2/20 0.30
▸ TAS1R2 Q8TE23 2/20 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
SCHEMBL1946824 0.74 HRH3 (0.32) —
SCHEMBL819057 0.72 — —
SCHEMBL6098447 0.70 ALDH1A1 (0.31) ALDH1A1
SCHEMBL16341689 0.69 MEN1 (0.32) ALDH1A1MEN1TSHRKMT2ATAS1R3
SCHEMBL16341692 0.69 MEN1 (0.32) ALDH1A1MEN1TSHRKMT2ATAS1R3
SCHEMBL16341733 0.69 MEN1 (0.32) ALDH1A1MEN1TSHRKMT2ATAS1R3
SCHEMBL16340854 0.69 MEN1 (0.32) ALDH1A1MEN1TSHRKMT2ATAS1R3
Hydrochloric Acid SCHEMBL14776763 0.69 HSP90AA1 (0.31) ALDH1A1
SCHEMBL29010438 0.68 ALDH1A1 (0.33) ALDH1A1MEN1TSHRKMT2AEBP
SCHEMBL16341125 0.68 MEN1 (0.30) ALDH1A1MEN1TSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2151446-B1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand RIMTEC CORP (JP) 2016-04-13 — — EP disclosed
EP-2151445-B1 Process for the preparation of bidentate Schiff base ruthenium catalysts containing a salicylaldimine-type ligand RIMTEC CORP (JP) 2015-02-18 — — EP disclosed
US-8338613-B2 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand RIMTEC CORPORATION (JP) 2012-12-25 — — US disclosed
US-20110137043-A1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand TELENE S.A.S. (FR) 2011-06-09 — — US disclosed
US-20110065925-A1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand TELENE S.A.S. (FR) 2011-03-17 — — US disclosed
EP-2151446-A1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand Telene SAS (FR) 2010-02-10 — — EP disclosed
EP-2151445-A1 Process for the preparation of bidentate Schiff base ruthenium cataysts containing a saliclyldimine-type ligand Telene SAS (FR) 2010-02-10 — — 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 (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-20110137043-A1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand SPR, LIG4, SUCLA2 ALDH1A1 1371/4885MEN1 3197/4885TSHR 3009/4885
US-20110065925-A1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand SPR, LIG4, SUCLA2 ALDH1A1 1371/4885MEN1 3197/4885TSHR 3009/4885

“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.

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