SCHEMBL345598

SCHEMBL345598

CN(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.48
GABRB2 P47870 1/20 0.48
CYP2C19 P33261 3/20 0.40
TSHR P16473 3/20 0.39
POLB P06746 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
ALOX15 P16050 1/20 0.38
RXRA P19793 4/20 0.38
RXRB P28702 4/20 0.38
RXRG P48443 4/20 0.38
SLC2A1 P11166 1/20 0.37
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
HIF1A Q16665 1/20 0.34
HTR1D P28221 1/20 0.33

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
SCHEMBL24625060 0.94 GABRA1 (0.42) GABRA1GABRB2CYP2C19TSHRPOLB
SCHEMBL14092975 0.89 GABRA1 (0.39) GABRA1GABRB2CYP2C19TSHRPOLB
SCHEMBL15315555 0.85 TSHR (0.38) GABRA1GABRB2CYP2C19TSHRPOLB
SCHEMBL15934276 0.84 GABRA1 (0.62) GABRA1GABRB2CYP2C19TSHRALDH1A1
SCHEMBL22181552 0.83 GABRA1 (0.48) GABRA1GABRB2CYP2C19TSHRPOLB
Phenol SCHEMBL28222015 0.82 GABRA1 (0.48) GABRA1GABRB2CYP2C19TSHRALDH1A1
SCHEMBL24522084 0.81 GABRA1 (0.46) GABRA1GABRB2CYP2C19TSHRPOLB
SCHEMBL93161 0.78 GABRA1 (0.69) GABRA1GABRB2CYP2C19TSHRPOLB
SCHEMBL23051506 0.76 GABRA1 (0.46) GABRA1GABRB2CYP2C19TSHRPOLB
SCHEMBL14372107 0.76 GABRA1 (0.52) GABRA1GABRB2CYP2C19POLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260144714-A1 KIT FOR PREPARING CURABLE COMPOSITION FOR DENTAL MATERIAL, CURABLE COMPOSITION FOR DENTAL MATERIAL, AND DENTAL MATERIAL MITSUI CHEMICALS, INC. (JP) 2026-05-28 US disclosed
US-12622847-B2 Organosilicon compound and dental composition containing same KURARAY NORITAKE DENTAL INC. (JP) 2026-05-12 US disclosed
US-20260124121-A1 POLYMERIZABLE DENTAL COMPOSITION TROETSCHLER TOBIAS (DE) 2026-05-07 US disclosed
EP-3861977-B1 (METH)ACRYLATE, MONOMER COMPOSITION, MOLDED BODY, COMPOSITION FOR DENTAL MATERIAL, AND DENTAL MATERIAL MITSUI CHEMICALS INC (JP) 2026-05-06 EP disclosed
EP-4736833-A1 POLYMERIZABLE DENTAL COMPOSITION DENTSPLY SIRONA Inc. (US) 2026-05-06 EP disclosed
EP-4725470-A1 CURABLE DENTAL COMPOSITION Kuraray Noritake Dental Inc. (JP) 2026-04-15 EP disclosed
US-12564543-B2 Dental composition KURARAY NORITAKE DENTAL INC. (JP) 2026-03-03 US disclosed
US-12527725-B2 Solvent-free dental adhesive composition KURARAY NORITAKE DENTAL INC. (JP) 2026-01-20 US disclosed
US-12478562-B2 Dental restoration material composition KURARAY NORITAKE DENTAL INC. (JP) 2025-11-25 US disclosed
EP-4649938-A1 DENTAL COMPOSITION Kuraray Noritake Dental Inc. (JP) 2025-11-19 EP disclosed
US-6410612-B1 ACRYLIC POLYMER BLEND KURARAY CO., LTD. (JP) 2002-06-25 US disclosed
US-20020035169-A1 Bonding compositions for dental use KURARAY CO., LTD (JP) 2002-03-21 US disclosed
US-6355704-B1 BACTERICIDE PRIMERS; BONDING TO TEETH KURARAY CO., LTD. (JP) 2002-03-12 US disclosed
US-20020016417-A1 Fitting composition, body-worn tool produced using the same, and method for producing the same KURARAY CO., LTD (JP) 2002-02-07 US disclosed
EP-1167408-A1 Fitting composition, body-worn tool produced using the same, and method for producing the same Kuraray Co., Ltd. (JP) 2002-01-02 EP disclosed
US-6191191-B1 USED AS BONDING AGENT, COMPOSITE RESIN, ADHESIVE AGENT, PRIMER AND OPAQUE PRIMER FOR DENTAL USE; LIGHT RESISTANCE; ADHESION TO TOOTH SURFACE AND METALS; COLORFASTNESS KURARAY CO., LTD. (JP) 2001-02-20 US disclosed
EP-1057468-A1 Adhesive composition and method for producing it KURARAY CO., LTD. (JP) 2000-12-06 EP disclosed
EP-1033125-A1 Relining material for dentures KURARAY CO., LTD. (JP) 2000-09-06 EP disclosed
EP-0980682-A1 Bonding compositions for dental use KURARAY CO., LTD. (JP) 2000-02-23 EP disclosed
EP-0948955-A1 POLYMERIZABLE DENTAL COMPOSITION KURARAY CO., LTD. (JP) 1999-10-13 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-20020035169-A1 Bonding compositions for dental use PTK2, DEK, POLK GABRA1 3555/4885GABRB2 4093/4885CYP2C19 3605/4885
US-12527725-B2 Solvent-free dental adhesive composition CDH1, ITGA1, ITGB8 GABRA1 2463/4885GABRB2 2392/4885CYP2C19 3721/4885
US-20260144714-A1 KIT FOR PREPARING CURABLE COMPOSITION FOR DENTAL MATERIAL, CURABLE COMPOSITION FOR DENTAL MATERIAL, AND DENTAL MATERIAL CAD, KIT, ILK GABRA1 4011/4885GABRB2 4600/4885CYP2C19 4006/4885
US-12564543-B2 Dental composition CAD, ARCN1, MAT1A GABRA1 1271/4885GABRB2 2384/4885CYP2C19 4120/4885
US-12478562-B2 Dental restoration material composition CAD, MAT2B, RER1 GABRA1 842/4885GABRB2 1582/4885CYP2C19 616/4885
US-12622847-B2 Organosilicon compound and dental composition containing same MSL1, ITGA1, ITGAL GABRA1 4487/4885GABRB2 4777/4885CYP2C19 1770/4885
US-20260124121-A1 POLYMERIZABLE DENTAL COMPOSITION F12, RAD51, PFN1 GABRA1 2518/4885GABRB2 3449/4885CYP2C19 1754/4885

“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.