SCHEMBL5165440

SCHEMBL5165440

COC(=O)c1cccc([I+]c2cccc(C(=O)OC)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.55
LOXL2 Q9Y4K0 1/20 0.54
CYP4F2 P78329 2/20 0.53
CYP4A11 Q02928 2/20 0.53
RAB9A P51151 3/20 0.51
POLB P06746 1/20 0.51
ALDH1A1 P00352 2/20 0.50
NPC1 O15118 2/20 0.49
CA12 O43570 2/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA9 Q16790 2/20 0.48
CA7 P43166 1/20 0.48
XDH P47989 1/20 0.48
CA14 Q9ULX7 1/20 0.48
GAA P10253 1/20 0.47
TP53 P04637 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPT P10636 1/20 0.46
SLC7A5 Q01650 1/20 0.46

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
SCHEMBL30516320 1.00 TSHR (0.55) TSHRLOXL2CYP4F2CYP4A11RAB9A
SCHEMBL795457 0.95 TSHR (0.60) TSHRLOXL2CYP4F2CYP4A11RAB9A
SCHEMBL29457307 0.93 LOXL2 (0.49) TSHRLOXL2CYP4F2CYP4A11RAB9A
SCHEMBL12556800 0.89 CYP4F2 (0.51) TSHRLOXL2CYP4F2CYP4A11RAB9A
SCHEMBL34953 0.83 TSHR (0.70) TSHRLOXL2CYP4F2CYP4A11RAB9A
SCHEMBL795706 0.82 LOXL2 (0.49) TSHRLOXL2CYP4F2CYP4A11RAB9A
SCHEMBL8054504 0.81 TSHR (0.67) TSHRLOXL2CYP4F2CYP4A11RAB9A
SCHEMBL9943503 0.81 TSHR (0.67) TSHRLOXL2CYP4F2CYP4A11RAB9A
SCHEMBL10941453 0.81 TSHR (0.67) TSHRLOXL2CYP4F2CYP4A11RAB9A
Potassium SCHEMBL30190417 0.81 TSHR (0.67) TSHRLOXL2CYP4F2CYP4A11RAB9A

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 72 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11883510-B2 Dental composition comprising a particulate carrier supporting a coinitiator DENTSPLY SIRONA INC. (US) 2024-01-30 US disclosed
US-11844848-B2 Photocurable dental composition DENTSPLY SIRONA INC. (US) 2023-12-19 US disclosed
US-11628125-B2 Photoinitiator modified polyacidic polymer DENTSPLY SIRONA INC. (US) 2023-04-18 US disclosed
US-20230100120-A1 DENTAL COMPOSITION COMPRISING A PARTICULATE CARRIER SUPPORTING A COINITIATOR DENTSPLY SIRONA INC. (US) 2023-03-30 US disclosed
EP-3675799-B1 DENTAL COMPOSITION COMPRISING A PARTICULATE CARRIER SUPPORTING A COINITIATOR DENTSPLY DETREY GMBH (DE) 2022-10-19 EP disclosed
EP-3470048-B1 PHOTOCURABLE DENTAL COMPOSITION DENTSPLY DETREY GMBH (DE) 2021-11-10 EP disclosed
EP-3675800-B1 PHOTOINITIATOR MODIFIED POLYACIDIC POLYMER DENTSPLY DETREY GMBH (DE) 2021-09-22 EP disclosed
US-20210186821-A1 PHOTOCURABLE DENTAL COMPOSITION DENTSPLY SIRONA INC. (US) 2021-06-24 US disclosed
US-20210069069-A1 DENTAL COMPOSITION COMPRISING A PARTICULATE CARRIER SUPPORTING A COINITIATOR DENTSPLY SIRONA INC. (US) 2021-03-11 US disclosed
US-20210069070-A1 PHOTOINITIATOR MODIFIED POLYACIDIC POLYMER DENTSPLY SIRONA INC. (US) 2021-03-11 US disclosed
US-7160666-B2 Photosensitive resin composition FUJI PHOTO FILM CO., LTD. (JP) 2007-01-09 US disclosed
US-20070003871-A1 Positive photosensitive composition FUJI PHOTO FILM CO., LTD. 2007-01-04 US disclosed
EP-1465579-A1 TERNARY PHOTOINITIATOR SYSTEM FOR CATIONICALLY POLYMERIZABLE RESINS 3M Innovative Properties Company (US) 2004-10-13 EP disclosed
EP-0931103-B1 MONOMERS, OLIGOMERS AND POLYMERS WITH TERMINAL OXIRANE GROUPS, METHOD OF PREPARATION AND POLYMERISATION UNDER RADIATION EXPOSURE UCB SA (BE) 2004-06-09 EP disclosed
WO-2003059295-A1 TERNARY PHOTOINITIATOR SYSTEM FOR CATIONICALLY POLYMERIZABLE RESINS 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-07-24 WO disclosed
US-6417243-B1 POLYESTERURETHANE BLOCKS UCB, S.A. (BE) 2002-07-09 US disclosed
US-6190834-B1 FIRST RESIN BEING AN EPOXY RESIN, AND A SECOND EPOXY RESIN HAVING AN N-SUBSTITUTED CARBAMIC ACID ESTER GROUP AND A RADICAL POLYMERIC UNSATURATED BOND IN ITS SIDE CHAIN HITACHI, LTD. (JP) 2001-02-20 US disclosed
EP-0931103-A1 MONOMERS, OLIGOMERS AND POLYMERS WITH TERMINAL OXIRANE GROUPS, METHOD OF PREPARATION AND POLYMERISATION UNDER RADIATION EXPOSURE UCB, S.A. (BE) 1999-07-28 EP disclosed
WO-1998014497-A1 MONOMERS, OLIGOMERS AND POLYMERS WITH TERMINAL OXIRANE GROUPS, METHOD OF PREPARATION AND POLYMERISATION UNDER RADIATION EXPOSURE UCB, S.A. (BE) 1998-04-09 WO disclosed
EP-0502382-A1 Light-sensitive composition and process SHIPLEY COMPANY INC. (US) 1992-09-09 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 (7 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-20230100120-A1 DENTAL COMPOSITION COMPRISING A PARTICULATE CARRIER SUPPORTING A COINITIATOR PICALM, PDS5B, CLTA TSHR 2840/4885LOXL2 4473/4885CYP4F2 3562/4885
US-20210069069-A1 DENTAL COMPOSITION COMPRISING A PARTICULATE CARRIER SUPPORTING A COINITIATOR PICALM, PDS5B, CLTA TSHR 2840/4885LOXL2 4473/4885CYP4F2 3562/4885
US-20210069070-A1 PHOTOINITIATOR MODIFIED POLYACIDIC POLYMER DOHH, OGDH, GGH TSHR 4455/4885LOXL2 4022/4885CYP4F2 2785/4885
US-11844848-B2 Photocurable dental composition TST, SULT1A1, SULT2A1 TSHR 4613/4885LOXL2 3932/4885CYP4F2 3615/4885
US-20210186821-A1 PHOTOCURABLE DENTAL COMPOSITION TST, SULT1A1, SULT2A1 TSHR 4613/4885LOXL2 3932/4885CYP4F2 3615/4885
US-11628125-B2 Photoinitiator modified polyacidic polymer DOHH, OGDH, GGH TSHR 4455/4885LOXL2 4022/4885CYP4F2 2785/4885
US-11883510-B2 Dental composition comprising a particulate carrier supporting a coinitiator PICALM, PDS5B, CLTA TSHR 2840/4885LOXL2 4473/4885CYP4F2 3562/4885

“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.