SCHEMBL4254296

SCHEMBL4254296

Pc1cccc(Cl)c1Cl.[Ru]

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
PNMT P11086 2/20 0.42
CYP1A2 P05177 3/20 0.41
CYP2A6 P11509 2/20 0.41
LMNA P02545 2/20 0.40
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 1/20 0.38
NFKB1 P19838 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
IDO1 P14902 3/20 0.37
ALDH1A1 P00352 3/20 0.37
GLA P06280 1/20 0.37
MAPK1 P28482 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
TDO2 P48775 1/20 0.34

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
SCHEMBL258606 0.97
SCHEMBL29152755 0.94 TSHR (0.46) TSHRPNMTCYP1A2CYP2A6LMNA
Hydrochloric Acid SCHEMBL22230526 0.94 TSHR (0.46) TSHRPNMTCYP1A2CYP2A6LMNA
SCHEMBL29126143 0.94 TSHR (0.46) TSHRPNMTCYP1A2CYP2A6LMNA
SCHEMBL828884 0.90 TSHR (0.42) TSHRPNMTCYP1A2CYP2A6LMNA
SCHEMBL10489573 0.76 TSHR (0.55) TSHRPNMTCYP1A2CYP2A6LMNA
SCHEMBL23239 0.75
SCHEMBL3991309 0.75 TSHR (0.61) TSHRPNMTCYP1A2CYP2A6LMNA
SCHEMBL6675833 0.73 CYP3A4 (0.48) TSHRPNMTCYP1A2CYP2A6LMNA
SCHEMBL970761 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102574989-B Polymer purification method and polymer MITSUI CHEMICALS INC 2014-03-26 CN disclosed
CN-102574989-A Polymer purification method and polymer MITSUI CHEMICALS INC 2012-07-11 CN disclosed
CN-101291944-B Process for producing organic transition metal complex compound, metathesis catalyst produced by the process, metathesis polymer formed by ring opening polymerization with the same, and process for pr MITSU CHEMICALS INC 2012-07-04 CN disclosed
CN-101490126-B Ring-opening metathesis polymer, hydrogenated product thereof, process for producing the same, and use thereof MITSUI CHEMICALS INC 2011-09-14 CN disclosed
CN-101490126-A Ring-opening metathesis polymer, hydrogenated product thereof, process for producing the same, and use thereof MITSUI CHEMICALS INC (JP) 2009-07-22 CN disclosed
US-20090124772-A1 PROCESS FOR PRODUCING ORGANIC TRANSITION METAL COMPLEX COMPOUND, METATHESIS CATALYST PRODUCED BY USING THE SAME, RING-OPENING METATHESIS POLYMER OBTAINABLE WITH THE METATHESIS CATALYST, AND PROCESS FOR PRODUCING THE POLYMER MITSUI CHEMICALS, INC. (JP) 2009-05-14 US disclosed
CN-101291944-A Process for producing organic transition metal complex compound, metathesis catalyst produced by the process, metathesis polymer formed by ring opening polymerization with the same, and process for pr MITSUI CHEMICALS INC (JP) 2008-10-22 CN disclosed
EP-1950216-A1 PROCESS FOR PRODUCING ORGANIC TRANSITION METAL COMPLEX COMPOUND, METATHESIS CATALYST PRODUCED BY THE PROCESS, METATHESIS POLYMER FORMED BY RING OPENING POLYMERIZATION WITH THE SAME, AND PROCESS FOR PRODUCING POLYMER WITH THE SAME Mitsui Chemicals, Inc. (JP) 2008-07-30 EP disclosed
CN-1249119-C Hydrogenated ring-opening metathesis copolymer and process for producing the same MITSUI CHEMICALS INC (JP) 2006-04-05 CN disclosed
CN-1233685-C Fluorinated cycloolefin polymer, cycloolefin monomer thereof, preparation method of polymer and application of polymer MITSUI CHEMICALS INC (JP) 2005-12-28 CN disclosed
CN-1462286-A Fluorinated cycloolefin polymers, its cycloolefin monomers processes for preparation of polymers thereof and use of the same MITSUI CHEMICALS INC (JP) 2003-12-17 CN disclosed
CN-1380888-A Hydrogenated ring-opening metathesis polymer and process for producing the same MITSUI CHEMICALS INC (JP) 2002-11-20 CN 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-20090124772-A1 PROCESS FOR PRODUCING ORGANIC TRANSITION METAL COMPLEX COMPOUND, METATHESIS CATALYST PRODUCED BY USING THE SAME, RING-OPENING METATHESIS POLYMER OBTAINABLE WITH THE METATHESIS CATALYST, AND PROCESS FOR PRODUCING THE POLYMER PORCN, ICMT, ME1 TSHR 4344/4885PNMT 210/4885CYP1A2 2537/4885

“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.