SCHEMBL1076307

SCHEMBL1076307

CC(C)c1ccc2ccc(C(C)C)c(N3[C]N(c4c(C(C)C)ccc5ccc(C(C)C)cc45)CC3)c2c1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.32
HTR1D P28221 2/20 0.32
HTR1B P28222 2/20 0.32
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
HTR7 P34969 1/20 0.30
ATM Q13315 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
SCHEMBL1076305 1.00 HPGD (0.32) HPGDHTR1DHTR1BMEN1KMT2A
SCHEMBL29282855 0.82
SCHEMBL1076308 0.80 KDM1A (0.36) HPGDHTR1DHTR1B
SCHEMBL11939021 0.80 MEN1 (0.33) HPGDHTR1DHTR1BMEN1KMT2A
SCHEMBL27971768 0.74 HTR2A (0.35) HTR1DHTR1BHTR7
SCHEMBL9893478 0.72 NR1H3 (0.34) HPGDMEN1KMT2A
SCHEMBL220287 0.71 GABRA1 (0.41) HPGDMEN1KMT2A
SCHEMBL25354539 0.70 KIF11 (0.42) HTR1D
SCHEMBL79573 0.66 UGT2B7 (0.42) HPGD
SCHEMBL19206406 0.65 TSHR (0.34) HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12012426-B2 Tetradentate diaminodiphosphine ligand and transition metal complex, and method for manufacturing same and application for same TAKASAGO INTERNATIONAL CORPORATION (JP) 2024-06-18 US disclosed
US-20230219983-A1 TETRADENTATE DIAMINODIPHOSPHINE LIGAND AND TRANSITION METAL COMPLEX, AND METHOD FOR MANUFACTURING SAME AND APPLICATION FOR SAME TAKASAGO INTERNATIONAL CORPORATION (JP) 2023-07-13 US disclosed
US-11639362-B2 Tetradentate diaminodiphosphine ligand and transition metal complex, and method for manufacturing same and application for same TAKASAGO INTERNATIONAL CORPORATION (JP) 2023-05-02 US disclosed
EP-3848378-A1 TETRADENTATE DIAMINODIPHOSPHINE LIGAND AND TRANSITION METAL COMPLEX, AND METHOD FOR MANUFACTURING SAME AND APPLICATION FOR SAME Takasago International Corporation (JP) 2021-07-14 EP disclosed
US-10072033-B2 N-(phosphinoalkyl)-N-(thioalkyl)amine derivative, method for producing same, and metal complex thereof TAKASAGO INTERNATIONAL CORPORATION (JP) 2018-09-11 US disclosed
US-20170233418-A1 N-(PHOSPHINOALKYL)-N-(THIOALKYL)AMINE DERIVATIVE, METHOD FOR PRODUCING SAME, AND METAL COMPLEX THEREOF TAKASAGO INTERNATIONAL CORPORATION (JP) 2017-08-17 US disclosed
EP-2276725-B1 NEW RUTHENIUM COMPLEXES AS CATALYSTS FOR METATHESIS REACTIONS HOFFMANN LA ROCHE (CH) 2012-07-04 EP disclosed
EP-2276725-A1 NEW RUTHENIUM COMPLEXES AS CATALYSTS FOR METATHESIS REACTIONS F. Hoffmann-La Roche AG (CH) 2011-01-26 EP disclosed
WO-2009124853-A1 NEW RUTHENIUM COMPLEXES AS CATALYSTS FOR METATHESIS REACTIONS F. HOFFMANN-LA ROCHE AG (CH) 2009-10-15 WO 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 (5 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-20170233418-A1 N-(PHOSPHINOALKYL)-N-(THIOALKYL)AMINE DERIVATIVE, METHOD FOR PRODUCING SAME, AND METAL COMPLEX THEREOF NSFL1C, TST, NCL HPGD 832/4885HTR1D 3212/4885HTR1B 2983/4885
US-20230219983-A1 TETRADENTATE DIAMINODIPHOSPHINE LIGAND AND TRANSITION METAL COMPLEX, AND METHOD FOR MANUFACTURING SAME AND APPLICATION FOR SAME ADH4, ADH5, PF4 HPGD 477/4885HTR1D 3133/4885HTR1B 2346/4885
US-12012426-B2 Tetradentate diaminodiphosphine ligand and transition metal complex, and method for manufacturing same and application for same ADH4, ADH5, PF4 HPGD 477/4885HTR1D 3133/4885HTR1B 2346/4885
US-11639362-B2 Tetradentate diaminodiphosphine ligand and transition metal complex, and method for manufacturing same and application for same ADH4, ADH5, PF4 HPGD 477/4885HTR1D 3133/4885HTR1B 2346/4885
US-10072033-B2 N-(phosphinoalkyl)-N-(thioalkyl)amine derivative, method for producing same, and metal complex thereof NSFL1C, TST, NCL HPGD 832/4885HTR1D 3212/4885HTR1B 2983/4885

“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.