SCHEMBL1109665

SCHEMBL1109665

CC(C)(C)c1ccc(-c2ccccc2I)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.42
KIF11 P52732 3/20 0.42
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
ALDH1A1 P00352 1/20 0.41
PLA2G1B P04054 1/20 0.41
NFKB1 P19838 1/20 0.41
CASP3 P42574 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
LMNA P02545 2/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PTAFR P25105 1/20 0.40
DGAT1 O75907 2/20 0.40

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
SCHEMBL31096463 1.00 S1PR1 (0.42) S1PR1KIF11NPC1RAB9AALDH1A1
Biphenyl SCHEMBL10827652 0.94 KIF11 (0.44) S1PR1KIF11NPC1RAB9AALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL1270052 0.84 HSD11B1 (0.40) NPC1RAB9AALDH1A1PLA2G1BNFKB1
SCHEMBL23523681 0.81 KIF11 (0.43) S1PR1KIF11NPC1RAB9AALDH1A1
SCHEMBL24017188 0.81 KIF11 (0.43) KIF11NPC1RAB9AALDH1A1PLA2G1B
SCHEMBL4904785 0.80 KIF11 (0.48) S1PR1KIF11NPC1RAB9AALDH1A1
SCHEMBL30477902 0.80 KIF11 (0.42) KIF11NPC1RAB9AALDH1A1PLA2G1B
SCHEMBL18087643 0.79 KIF11 (0.42) KIF11NPC1RAB9AALDH1A1PLA2G1B
SCHEMBL5695818 0.79 KIF11 (0.56) KIF11ALDH1A1MEN1KMT2ATSHR
Hydrogen Sulfide SCHEMBL27571146 0.78 KIF11 (0.47) S1PR1KIF11NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3593786-B1 PHOTOCURABLE COMPOSITION AND DENTAL RESTORATION FILLING MATERIAL TOKUYAMA DENTAL CORP (JP) 2022-05-18 EP claimed
CN-101547913-A Photoactive compounds AZ ELECTRONIC MATERIALS USA (US) 2009-09-30 CN claimed
US-20260035592-A1 CATIONICALLY POLYMERIZABLE RESIN COMPOSITION FOR THREE-DIMENSIONAL PHOTOFABRICATION AND METHOD FOR PRODUCING THREE-DIMENSIONAL PHOTOFABRICATED PRODUCT TOKUYAMA DENTAL CORPORATION (JP) 2026-02-05 US disclosed
US-20250213434-A1 DENTAL CURABLE COMPOSITION HAVING FAVORABLE COLOR COMPATIBILITY KURARAY NORITAKE DENTAL INC. (JP) 2025-07-03 US disclosed
US-20250101205-A1 COMPOSITE OXIDE PARTICLES, METHOD FOR PRODUCING SAME, AND CURABLE COMPOSITION TOKUYAMA DENTAL CORPORATION (JP) 2025-03-27 US disclosed
EP-4505992-A1 DENTAL CURABLE COMPOSITION HAVING FAVORABLE COLOR COMPATIBILITY Kuraray Noritake Dental Inc. (JP) 2025-02-12 EP disclosed
EP-4470975-A1 COMPOSITE OXIDE PARTICLES, METHOD FOR PRODUCING SAME, AND CURABLE COMPOSITION Tokuyama Dental Corporation (JP) 2024-12-04 EP disclosed
EP-4091578-B1 METHOD FOR PRODUCING PLATE DENTURE TOKUYAMA DENTAL CORP (JP) 2024-10-09 EP disclosed
US-20240180788-A1 PHOTOCATIONICALLY CURABLE COMPOSITION TOKUYAMA DENTAL CORPORATION (JP) 2024-06-06 US disclosed
WO-2024075641-A1 POLYMER MATERIAL FOR USE IN DENTISTRY サンメディカル株式会社 2024-04-11 WO disclosed
WO-2024038705-A1 CATIONICALLY POLYMERIZABLE RESIN COMPOSITION FOR 3D STEREOLITHOGRAPHY AND METHOD FOR PRODUCING 3D STEREOLITHOGRAPHY PRODUCT 株式会社トクヤマデンタル 2024-02-22 WO disclosed
EP-0824720-A1 ACID BLEACHABLE DYE CONTAINING LITHOGRAPHIC PRINTING PLATE COMPOSITION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-02-25 EP disclosed
US-5665522-A Visible image dyes for positive-acting no-process printing plates MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-09-09 US disclosed
WO-1996035143-A1 ACID BLEACHABLE DYE CONTAINING LITHOGRAPHIC PRINTING PLATE COMPOSITION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-11-07 WO disclosed
EP-0119067-B1 PROCESS FOR PREPARING ALDEHYDES NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1986-11-26 EP disclosed
US-4607116-A FROM DIARYLIODONIUM SALT NIPPON PETROCHEMICALS COMPANY LIMITED (JP) 1986-08-19 US disclosed
EP-0119065-B1 PROCESS FOR PREPARING DIARYLS NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1986-08-13 EP disclosed
US-4590281-A REACTING DIARYLIODONIUM SALT WITH UNSATURATED ALCOHOL NIPPON PETROCHEMICALS COMPANY (JP) 1986-05-20 US disclosed
EP-0119065-A1 Process for preparing diaryls NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1984-09-19 EP disclosed
EP-0119067-A1 Process for preparing aldehydes NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1984-09-19 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-20240180788-A1 PHOTOCATIONICALLY CURABLE COMPOSITION CRY1, CRY2, TYR S1PR1 4590/4885KIF11 1540/4885NPC1 4712/4885
US-20260035592-A1 CATIONICALLY POLYMERIZABLE RESIN COMPOSITION FOR THREE-DIMENSIONAL PHOTOFABRICATION AND METHOD FOR PRODUCING THREE-DIMENSIONAL PHOTOFABRICATED PRODUCT TERB1, CAD, C9 S1PR1 3128/4885KIF11 4690/4885NPC1 4147/4885

“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.