SCHEMBL2849047

SCHEMBL2849047

CCCC[SnH](c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.42
▸ PCSK9 Q8NBP7 1/20 0.42
▸ LTA4H P09960 2/20 0.38
▸ OPRM1 P35372 1/20 0.37
▸ OPRL1 P41146 1/20 0.37
▸ PTGS2 P35354 1/20 0.36
▸ CES2 O00748 2/20 0.35
▸ CES1 P23141 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ SIGMAR1 Q99720 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ PSIP1 O75475 1/20 0.34
▸ TSHR P16473 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
SCHEMBL28438373 0.91 DNM1 (0.40) TDP1PCSK9LTA4HCES2CES1
SCHEMBL2850629 0.81 TDP1 (0.38) TDP1PCSK9LTA4HPTGS2CES2
SCHEMBL11028855 0.77 SMN1; SMN2 (0.40) SMN1; SMN2
SCHEMBL9568181 0.74 TP53 (0.41) TDP1PCSK9LTA4HCES2CES1
SCHEMBL27583072 0.73 DNM1 (0.40) LTA4HCES2CES1SMN1; SMN2SIGMAR1
SCHEMBL9746250 0.73 PCSK9 (0.36) TDP1PCSK9LTA4HPTGS2CES2
Toluene SCHEMBL27536751 0.70 TSHR (0.50) PCSK9LTA4HPTGS2CES2CES1
Benzenethiol SCHEMBL9622099 0.68 LTA4H (0.35) TDP1PCSK9LTA4HPTGS2CES2
SCHEMBL9720431 0.68 TP53 (0.42) SMN1; SMN2SIGMAR1TP53
SCHEMBL10739965 0.68 TP53 (0.42) SMN1; SMN2SIGMAR1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7781610-B2 Heterogeneous organotin catalysts CHEMTURA CORPORATION (US) 2010-08-24 — — US disclosed
US-7772417-B2 Heterogeneous organotin catalysts CHEMTURA CORPORATION (US) 2010-08-10 — — US disclosed
US-20100174106-A1 HETEROGENEOUS ORGANOTIN CATALYSTS CHEMTURA CORPORATION (US) 2010-07-08 — — US disclosed
US-20100152477-A1 HETEROGENEOUS ORGANOTIN CATALYSTS CHEMTURA CORPORATION (US) 2010-06-17 — — US disclosed
US-7687581-B2 Heterogeneous organotin catalysts CHEMTURA CORPORATION (US) 2010-03-30 — — US disclosed
EP-1598381-B1 Heterogeneous organotin catalysts CHEMTURA ORGANOMETALLICS GMBH (DE) 2006-10-18 — — EP disclosed
CN-1714935-A Heterogeneous organotin catalysts CROMPTON GMBH (DE) 2006-01-04 — — CN disclosed
US-20050261444-A1 Heterogeneous organotin catalysts GLCC LAUREL, LLC 2005-11-24 — — US disclosed
EP-1598381-A1 Heterogeneous organotin catalysts Crompton GmbH (DE) 2005-11-23 — — EP disclosed
US-5194365-A Method for forming images CIBA-GEIGY CORPORATION (US) 1993-03-16 — — 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-20100174106-A1 HETEROGENEOUS ORGANOTIN CATALYSTS ATXN2L, CDYL, ZYX TDP1 3740/4885PCSK9 4743/4885LTA4H 1418/4885
US-20100152477-A1 HETEROGENEOUS ORGANOTIN CATALYSTS ATXN2L, CDYL, ZYX TDP1 3740/4885PCSK9 4743/4885LTA4H 1418/4885

“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.

Send feedback